C43H55N4O10P URIDINE, 5 ′ -O- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -o- (2-methox-anthyl)-5-methyl-, 3 ′-[2-cyanoethyl n (aci) ffasthyl (1-mosphyl

nghynnyrch

C43H55N4O10P URIDINE, 5 ′ -O- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -o- (2-methox-anthyl)-5-methyl-, 3 ′-[2-cyanoethyl n (aci) ffasthyl (1-mosphyl

Gwybodaeth Sylfaenol:


Manylion y Cynnyrch

Tagiau cynnyrch

Manylion Sylweddau

Rhif Cofrestrfa CAS

163878-63-5

H302

Priodweddau Ffisegol Allweddol Gwerthfawrogom Cyflyrasoch
Pwysau moleciwlaidd 818.89 -
PKA (a ragwelir) 9.55 ± 0.10 Mwyaf Temp Asidig: 25 ° C.

Enwau a dynodwyr eraill

Gwenau canonaidd

N#CCCOP (OC1C (OC (N2C = C (C (= O) NC2 = O) C) C1OcCOC) COC (C = 3c = CC = CC3) (C4 = CC = C (OC) C = C4) C5 = CC = CC = C (oc) c = c) n (c

Gwenau isomerig

C (OC [C @@ H] 1 [C @@ H] (OP (N (C (C (C) C) C (C) C) OCCC#N) [C @@ H] (OCCOC) [C @@ H] (O1) N2C (= O) NC (= O) C (C) = C) = C2) (C3 = C = C) = C (OC) C = C4) C5 = CC = CC = C5

Inchi

Inchi = 1s/c43h55n4o10p/c1-29 (2) 47 (30 (3) 4) 58 (55-24-12-23-44) 57-38-37 (56-41 (39 (38) 53-26-26-25-50-6) 46) 46 46 8-54-43 (32-13-10-9-11-14-32,33-15-19-35 (51-7) 20-16-33) 34-17-21-36 (52-8) 22-18-34/H9-11,11,13-22,27,29-33,13, 12421H, 124-242 1-8H3, (H, 45,48,49)/T37-, 38-, 39-, 41-, 58?/M1/S1

Allwedd inchi

YfrrkzDUdUdxHjnc-KZQAAKllSA-N

17 ENW arall ar gyfer y sylwedd hwn

Uridine, 5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′-O-(2-methoxyethyl)-5-methyl-, 3 ′-[2-cyanoethyl bis (1-methylethyl) ffosffor

amidite] (9ci); 10: PN: US20030212017 Tudalen: 18 Hawliedig RNA; 11: PN: US20030211606 Tudalen: 18 Hawliedig RNA; 13: PN: US20040

005569 Tudalen: 21 honnodd RNA; 13: PN: US20040006030 Tudalen: 22 Hawliedig RNA; 13: PN: US20040014048 Tudalen: 19 Hawliedig RNA; 13: PN: US20040014049 Tudalen: 19 Hawliedig RNA; 14: PN: US20030198965 Tudalen: 19 Hawliedig RNA; 14: PN: US20040005565 Tudalen: 17- 22 Hawliedig RNA; 14: PN: US20040005570 Tudalen: 19 Hawliedig RNA; 14: PN: US20040014047 Tudalen: 19 Hawliedig RNA; 14: PN: US20040

014699 Tudalen: 19 honnodd RNA; 15: PN: US20040014050 Tudalen: 19 Hawliedig RNA; 15: PN: US20040014051 Tudalen: 21 Hawliedig RNA; 15:

PN: WO03106645 Tudalen: 69 Hawliedig RNA; 16: PN: US20040006029 Tudalen: 22 Hawliedig RNA; 87: PN: US20040005707 Tudalen: 19 Hawliedig RNA

Sbectra arbrofol

Sbectra ar gael
1 h nmr
13 C NMR
Hetero nmr

Eiddo a ragwelir

Eiddo ar gael
Biolegol
Gemegol
Lipinski
Strwythur yn gysylltiedig

Biolegol

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Ffactor Bio -ganolbwynt 348 Ph 1; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 2810 Ph 2; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 21100 Ph 3; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 63100 Ph 4; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 78800 Ph 5; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 80800 Ph 6; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 80800 Ph 7; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 78800 Ph 8; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 63400 Ph 9; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 21800 Ph 10; TEMP: 25 ° C. (1) ACD

(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)

Gemegol

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Koc 487 Ph 1; TEMP: 25 ° C. (1) ACD
Koc 3940 Ph 2; TEMP: 25 ° C. (1) ACD
Koc 29600 Ph 3; TEMP: 25 ° C. (1) ACD
Koc 88400 Ph 4; TEMP: 25 ° C. (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Koc 1.10 x 105 Ph 5; TEMP: 25 ° C. (1) ACD
Koc 1.13 x 105 Ph 6; TEMP: 25 ° C. (1) ACD
Koc 1.13 x 105 Ph 7; TEMP: 25 ° C. (1) ACD
Koc 1.10 x 105 Ph 8; TEMP: 25 ° C. (1) ACD
Koc 88800 Ph 9; TEMP: 25 ° C. (1) ACD
Koc 30600 Ph 10; TEMP: 25 ° C. (1) ACD
log 4.39 Ph 1; TEMP: 25 ° C. (1) ACD
log 5.30 Ph 2; TEMP: 25 ° C. (1) ACD
log 6.18 Ph 3; TEMP: 25 ° C. (1) ACD
log 6.65 Ph 4; TEMP: 25 ° C. (1) ACD
log 6.75 Ph 5; TEMP: 25 ° C. (1) ACD
log 6.76 Ph 6; TEMP: 25 ° C. (1) ACD
log 6.76 Ph 7; TEMP: 25 ° C. (1) ACD
log 6.75 Ph 8; TEMP: 25 ° C. (1) ACD
log 6.65 Ph 9; TEMP: 25 ° C. (1) ACD
log 6.19 Ph 10; TEMP: 25 ° C. (1) ACD
logio 6.761 ± 0.669 TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​torfol 2.0 x 10-4 g/l TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 0.046 g/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 5.7 x 10-3 g/l Ph 2; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 7.6 x 10-4 g/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.5 x 10-4 g/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.0 x 10-4 g/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.0 x 10-4 g/l Ph 6; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.0 x 10-4 g/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.0 x 10-4 g/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.5 x 10-4 g/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 7.4 x 10-4 g/l Ph 10; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.0 x 10-4 g/l Dŵr heb ei drin pH 7.00; TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​molar 2.4 x 10-7 mol/l TEMP: 25 ° C. (1) ACD
Hydoddedd molar 5.6 x 10-5 mol/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 7.0 x 10-6 mol/l Ph 2; TEMP: 25 ° C. (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Hydoddedd molar 9.3 x 10-7 mol/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 3.1 x 10-7 mol/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.5 x 10-7 mol/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.4 x 10-7 mol/l Ph 6; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.4 x 10-7 mol/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.5 x 10-7 mol/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 3.1 x 10-7 mol/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 9.0 x 10-7 mol/l Ph 10; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.4 x 10-7 mol/l Dŵr heb ei drin pH 7.00; TEMP: 25 ° C. (1) ACD
Pwysau moleciwlaidd 818.89    
PKA 9.55 ± 0.10 Mwyaf Temp Asidig: 25 ° C. (1) ACD
PKA 3.45 ± 0.70 Temp mwyaf sylfaenol: 25 ° C. (1) ACD

(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)

Lipinski

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Bondiau rotatable yn rhydd 21   (1) ACD
H Derbynyddion 14   (1) ACD
H rhoddwyr 1   (1) ACD
H rhoddwr/derbynnydd swm 15   (1) ACD
logio 6.761 ± 0.669 TEMP: 25 ° C. (1) ACD
Pwysau moleciwlaidd 818.89    

(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)

Strwythur yn gysylltiedig

Eiddo Gwerthfawrogom Ffynhonnell Cyflwr
Arwynebedd pegynol 164 A2 (1) ACD

(1) wedi'i gyfrifo gan ddefnyddio Meddalwedd Datblygu Cemeg Uwch (ACD/LABS) V11.02 (© 1994-2023 ACD/LABS)

Sbectra a ragwelir

Sbectra ar gael
1 h nmr
13 C NMR

Datganiadau Perygl GHS

Ffynhonnell Datganiad Perygl Cod
H302 niweidiol os caiff ei lyncu Dosbarthiad a Labelu Asiantaeth Gemegol Ewropeaidd (ECHA)

Rhestr - Dosbarthiad a Labelu Hysbysedig - Hysbysiadau Mwyaf Cyffredin, Asiantaeth Gemegol Ewropeaidd (ECHA)

Rhestr Dosbarthu a Labelu - Dosbarthiad a Labelu Hysbysedig - Hysbysiadau mwyaf difrifol


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