Ffôn: 86-512-52678575
C42H52N5O9P cytidine, n-acetyl-5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -o- methyl-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl) ffosffoliti

nghynnyrch

C42H52N5O9P cytidine, n-acetyl-5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -o- methyl-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl) ffos (actorio) ffosffolitite
  • C42H52N5O9P cytidine, n-acetyl-5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -o- methyl-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl) ffosffoliti

C42H52N5O9P cytidine, n-acetyl-5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -o- methyl-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl) ffosffoliti

Gwybodaeth Sylfaenol:


Manylion y Cynnyrch

Tagiau cynnyrch

Manylion Sylweddau

Rhif Cofrestrfa CAS

199593-09-4

Priodweddau Ffisegol Allweddol Gwerthfawrogom Cyflyrasoch
Pwysau moleciwlaidd 801.87 -
PKA (a ragwelir) 10.18 ± 0.20 Mwyaf Temp Asidig: 25 ° C.

Enwau a dynodwyr eraill

Gwenau canonaidd

N#CCCOP (OC1C (OC (N2C = CC (= NC2 = O) NC (= O) C) C1OC) COC (C = 3C = CC = CC3) (C4 = CC = C (OC) C = C4) C5 = CC = C = C (oc) C = C

Gwenau isomerig

C (OC [C @@ H] 1 [C @@ H] (OP (N (C (C (C) C) C (C) C) OCCC#N) [C @@ H] (OC) [c @@ H] (o1) n2C (= O) n = c (nc (c) = o) = o) c = c = c2) (c 1) (c = C (OC) C = C4) C5 = CC = CC = C5

Inchi

Inchi = 1s/c42h52n5o9p/c1-28 (2) 47 (29 (3) 4) 57 (54-26-12-24-43) 56-38-36 (55-40 (39 (38) 52-8) 46-25-23-41 (45- 48 (44- 48 (44- 48 (45- 48 (44- 48 (45-41 (45-41) -42 (31-13-10-9-11-14-31,32-15-19-34 (50-6) 20-16-32) 33-17-21-35 (51-7) 22-18-33/H9-11,1,13-23,25,25,28-29,36,36-40H, 1222222222222222222226-226-2222226-2222226-226-2226-222226-222226-22222226-2222226-22226-226-22222222222 H, 44,45,48,49)/T36-, 38-, 39-, 40-, 57?/M1/S1

Allwedd inchi

Wnwumipfloktez-uaqipllrsa-n

1 enw arall ar y sylwedd hwn

Cytidine,N-acetyl -5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′-O-methyl-, 3 ′-[2-cyanoethyl bis (1-methylethyl) phosphoramidite] (9ci)

Eiddo ar gael
Biolegol
Gemegol
Lipinski
Strwythur yn gysylltiedig

Biolegol

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Ffactor Bio -ganolbwynt 4.77 Ph 1; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 50.1 Ph 2; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 2190 Ph 3; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 21700 Ph 4; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 35700 Ph 5; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 37800 Ph 6; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 37900 Ph 7; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 37300 Ph 8; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 31400 Ph 9; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 12300 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

Ffynhonnell Cyflwr Gwerth Eiddo
Koc 8.29 pH 1; TEMP: 25 ° C (1) ACD
Koc 87.1 pH 2; TEMP: 25 ° C (1) ACD
KOC 3800 pH 3; TEMP: 25 ° C (1) ACD
KOC 37700 pH 4; TEMP: 25 ° C (1) ACD
KOC 62000 pH 5; TEMP: 25 ° C (1) ACD
KOC 65700 pH 6; TEMP: 25 ° C (1) ACD
KOC 65900 pH 7; TEMP: 25 ° C (1) ACD
KOC 64700 pH 8; TEMP: 25 ° C (1) ACD
KOC 54500 pH 9; TEMP: 25 ° C (1) ACD
KOC 21400 pH 10; TEMP: 25 ° C (1) ACD
logd 2.43 pH 1; TEMP: 25 ° C (1) ACD
logd 3.45 pH 2; TEMP: 25 ° C (1) ACD
logd 5.09 pH 3; TEMP: 25 ° C (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
log 6.09 Ph 4; TEMP: 25 ° C. (1) ACD
log 6.30 Ph 5; TEMP: 25 ° C. (1) ACD
log 6.33 Ph 6; TEMP: 25 ° C. (1) ACD
log 6.33 Ph 7; TEMP: 25 ° C. (1) ACD
log 6.32 Ph 8; TEMP: 25 ° C. (1) ACD
log 6.25 Ph 9; TEMP: 25 ° C. (1) ACD
log 5.84 Ph 10; TEMP: 25 ° C. (1) ACD
logio 6.329 ± 0.771 TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​torfol 1.8 x 10-4 g/l TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.4 g/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 0.14 g/l Ph 2; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.1 x 10-3 g/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.2 x 10-4 g/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.9 x 10-4 g/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.8 x 10-4 g/l Ph 6; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.8 x 10-4 g/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.8 x 10-4 g/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.2 x 10-4 g/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 5.6 x 10-4 g/l Ph 10; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.8 x 10-4 g/l Dŵr heb ei drin pH 7.00; TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​molar 2.3 x 10-7 mol/l TEMP: 25 ° C. (1) ACD
Hydoddedd molar 1.8 x 10-3 mol/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 1.7 x 10-4 mol/l Ph 2; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 3.9 x 10-6 mol/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 4.0 x 10-7 mol/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.4 x 10-7 mol/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.3 x 10-7 mol/l Ph 6; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.3 x 10-7 mol/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.3 x 10-7 mol/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.8 x 10-7 mol/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 7.0 x 10-7 mol/l Ph 10; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.3 x 10-7 mol/l Dŵr heb ei drin pH 7.00; TEMP: 25 ° C. (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Pwysau moleciwlaidd 801.87    
PKA 10.18 ± 0.20 Mwyaf Temp Asidig: 25 ° C. (1) ACD
PKA 3.57 ± 0.20 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 18   (1) ACD
H Derbynyddion 14   (1) ACD
H rhoddwyr 1   (1) ACD
H rhoddwr/derbynnydd swm 15   (1) ACD
logio 6.329 ± 0.771 TEMP: 25 ° C. (1) ACD
Pwysau moleciwlaidd 801.87    

(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 167 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

  • Blaenorol:
  • Nesaf:
    • Ysgrifennwch eich neges yma a'i hanfon atom

    Cynhyrchion Cysylltiedig