C31H32N2O8 URIDINE, 5'-O- [bis (4-methoxyphenyl) phenylmethyl] -2'-o-methyl- (9c i, aci)

nghynnyrch

C31H32N2O8 URIDINE, 5'-O- [bis (4-methoxyphenyl) phenylmethyl] -2'-o-methyl- (9c i, aci)

Gwybodaeth Sylfaenol:


Manylion y Cynnyrch

Tagiau cynnyrch

Priodweddau Ffisegol

Priodweddau Ffisegol Allweddol Gwerthfawrogom Cyflyrasoch
Pwysau moleciwlaidd 560.60 -
Dwysedd (a ragwelir) 1.35 ± 0.1 g/cm3 Temp: 20 ° C; Gwasg: 760 Torr
PKA (a ragwelir) 9.39 ± 0.10 Mwyaf Temp Asidig: 25 ° C.

Enwau a dynodwyr eraill

Gwên Canonaidd O = C1c = Cn (C (= O) N1) C2OC (COC (C = 3C = CC = CC3) (C4 = CC = C (OC) C = C4) C5 = CC = C (OC) C = C5) C (O) C2OC
Gwên isomerig C (OC [C@H] 1O [C@H] ([C@H] (OC) [C @@ H] 1O) N2C (= O) NC (= O) C = C2) (C3 = CC = C (C (OC) C = C3) (C4 = CC = C = C = C = C1) C4) C1) C4) C1 = C
Inchi
Inchi = 1s/c31h32n2o8/c1-37-23-13-9-21 (10-14-23) 31 (20-7-5-4-6-8-8-20,22-11-15-24 (38-2) 16-12-22) 40-19-25-27 (35) 28 (39-3)
33-18-17-26 (34) 32-30 (33) 36/H4-18,25,27-29,35H, 19h2,1-3h3, (H, 32,34,36)/t25-, 27-, 28-, 29-/m1/s1
Allwedd inchi
Mfdhavfjdsrpkc-yxinzvnlsa-n
2 enw arall ar gyfer y sylwedd hwn
5'-o- [bis (4-methoxyphenyl) phenylmethyl] -2'-o-methyluridine (ACI); 5'-o- (4,4'-dimethoxytrityl) -2'-o-methyluridine

Sbectra arbrofol

Sbectra ar gael
1h nmr
Torfol

Eiddo a ragwelir

Eiddo ar gael
Biolegol
Gemegol
Ddwysedd
Lipinski
Strwythur yn gysylltiedig

Biolegol

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Ffactor Bio -ganolbwynt 1240 Ph 1; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1240 Ph 2; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1240 Ph 3; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1240 Ph 4; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1240 Ph 5; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1240 Ph 6; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1230 Ph 7; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1190 Ph 8; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 861 Ph 9; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 238 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 5690 Ph 1; TEMP: 25 ° C. (1) ACD
Koc 5690 Ph 2; TEMP: 25 ° C. (1) ACD
Koc 5690 Ph 3; TEMP: 25 ° C. (1) ACD
Koc 5690 Ph 4; TEMP: 25 ° C. (1) ACD
Koc 5690 Ph 5; TEMP: 25 ° C. (1) ACD
Koc 5690 Ph 6; TEMP: 25 ° C. (1) ACD
Koc 5670 Ph 7; TEMP: 25 ° C. (1) ACD
Koc 5450 Ph 8; TEMP: 25 ° C. (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Koc 3960 Ph 9; TEMP: 25 ° C. (1) ACD
Koc 1100 Ph 10; TEMP: 25 ° C. (1) ACD
log 4.37 Ph 1; TEMP: 25 ° C. (1) ACD
log 4.37 Ph 2; TEMP: 25 ° C. (1) ACD
log 4.37 Ph 3; TEMP: 25 ° C. (1) ACD
log 4.37 Ph 4; TEMP: 25 ° C. (1) ACD
log 4.37 Ph 5; TEMP: 25 ° C. (1) ACD
log 4.37 Ph 6; TEMP: 25 ° C. (1) ACD
log 4.37 Ph 7; TEMP: 25 ° C. (1) ACD
log 4.35 Ph 8; TEMP: 25 ° C. (1) ACD
log 4.21 Ph 9; TEMP: 25 ° C. (1) ACD
log 3.66 Ph 10; TEMP: 25 ° C. (1) ACD
logio 4.372 ± 0.582 TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​torfol 3.7 x 10-4 g/l TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.7 x 10-4 g/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.7 x 10-4 g/l Ph 2; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.7 x 10-4 g/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.7 x 10-4 g/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.7 x 10-4 g/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.7 x 10-4 g/l Ph 6; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.7 x 10-4 g/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.8 x 10-4 g/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 5.3 x 10-4 g/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.9 x 10-3 g/l Ph 10; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.7 x 10-4 g/l Dŵr heb ei drin pH 6.99; TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​molar 6.6 x 10-7 mol/l TEMP: 25 ° C. (1) ACD
Hydoddedd molar 6.6 x 10-7 mol/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 6.6 x 10-7 mol/l Ph 2; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 6.6 x 10-7 mol/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 6.6 x 10-7 mol/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 6.6 x 10-7 mol/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 6.6 x 10-7 mol/l Ph 6; TEMP: 25 ° C. (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Hydoddedd molar 6.6 x 10-7 mol/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 6.8 x 10-7 mol/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 9.4 x 10-7 mol/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 3.4 x 10-6 mol/l Ph 10; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 6.6 x 10-7 mol/l Dŵr heb ei drin pH 6.99; TEMP: 25 ° C. (1) ACD
Pwysau moleciwlaidd 560.60    
PKA 9.39 ± 0.10 Mwyaf Temp Asidig: 25 ° C. (1) ACD

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

Ddwysedd

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Ddwysedd 1.35 ± 0.1 g/cm3 Temp: 20 ° C; Gwasg: 760 Torr (1) ACD
Cyfaint molar 412.9 ± 5.0 cm3/mol Temp: 20 ° C; Gwasg: 760 Torr (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 11   (1) ACD
H Derbynyddion 10   (1) ACD
H rhoddwyr 2   (1) ACD
H rhoddwr/derbynnydd swm 12   (1) ACD
logio 4.372 ± 0.582 TEMP: 25 ° C. (1) ACD
Pwysau moleciwlaidd 560.60    

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

Strwythur yn gysylltiedig

Eiddo Gwerthfawrogom

Cyflyrasoch

Ffynhonnell
Arwynebedd pegynol 116 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
1h nmr
13c nmr


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