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C39H46FN4O8P wridine, 5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -deoxy-2 ′-fflworo-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl ffos (1-methylethyl ffosffolitite

nghynnyrch

C39H46FN4O8P URIDINE, 5 ′ -O- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -deoxy-2 ′-fluoro-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl) ffosffolitite ffosffolitite ffosffoliti
  • C39H46FN4O8P wridine, 5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -deoxy-2 ′-fflworo-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl ffos (1-methylethyl ffosffolitite

C39H46FN4O8P wridine, 5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′ -deoxy-2 ′-fflworo-, 3 ′-[2-cyanoethyl n, n-bis (1-methylethyl ffos (1-methylethyl ffosffolitite

Gwybodaeth Sylfaenol:


Manylion y Cynnyrch

Tagiau cynnyrch

Manylion Sylweddau

Rhif Cofrestrfa CAS

146954-75-8

Priodweddau Ffisegol Allweddol Gwerthfawrogom Cyflyrasoch
Pwysau moleciwlaidd 748.78 -
PKA (a ragwelir) 9.39 ± 0.10 Mwyaf Temp Asidig: 25 ° C.

Enwau a dynodwyr eraill

Gwenau canonaidd

N#CCCOP (OC1C (F) C (OC1COC (C = 2C = CC = CC2) (C3 = CC = C (OC) C = C3) C4 = CC = C (OC) C = C4) N5C = CC (= O) NC5 = O) N (C) C

Gwenau isomerig

C (OC [C @@ H] 1 [C @@ H] (OP (N (C (C (C) C) C (C) C) OCCC#N) [C @@ H] (F) [C @@ H] (O1) N2C (= O) NC (= O) C = C = C2) (C3 = C1 = C = C = C = C 1) (C3) (C3) (C3) (C3) (C C4) C5 = CC = CC = C5

Inchi

Inchi = 1s/c39h46fn4o8p/c1-26 (2) 44 (27 (3) 4) 53 (50-24-10-22-41) 52-36-33 (51-37 (35 (36) 40) 40) 43-23-21-39 (45-38) 25-38 (4238 (4238 (428) (4238 (428) 25-38 (4238 (4238 (4238 (4238 (4238 (4238 (4238) 25- -8-7-9-12-28,29-13-17-31 (47-5) 18-14-29) 30-15-19-32 (48-6) 20-16-30/H7-9,11-21,23,23,26-27,33,33,35-37) 3-, 35-, 36-, 37-, 53?/M1/S1

Allwedd inchi

HqhqpayrjJMyqx-djtpzyMwsa-n

1 enw arall ar y sylwedd hwn

Uridine, 5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′ -deoxy-2 ′ -fluoro-, 3 ′-[2-cyanoethyl bis (1-methylethyl) ffosfforamidite] (9ci)

Eiddo ar gael
Biolegol
Gemegol
Lipinski
Strwythur yn gysylltiedig

Biolegol

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Ffactor Bio -ganolbwynt 457 Ph 1; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 3690 Ph 2; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 27700 Ph 3; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 82900 Ph 4; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.04 x 105 Ph 5; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.06 x 105 Ph 6; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.06 x 105 Ph 7; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.02 x 105 Ph 8; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 76200 Ph 9; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 22000 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 592 pH 1; TEMP: 25 ° C (1) ACD
KOC 4790 pH 2; TEMP: 25 ° C (1) ACD
KOC 36000 pH 3; TEMP: 25 ° C (1) ACD
KOC 1.07 x 105 pH 4; TEMP: 25 ° C (1) ACD
KOC 1.34 x 105 pH 5; TEMP: 25 ° C (1) ACD
KOC 1.38 x 105 pH 6; TEMP: 25 ° C (1) ACD
KOC 1.37 x 105 pH 7; TEMP: 25 ° C (1) ACD
KOC 1.33 x 105 pH 8; TEMP: 25 ° C (1) ACD
KOC 98800 pH 9; TEMP: 25 ° C (1) ACD
Koc 28600 pH 10; TEMP: 25 ° C (1) ACD
logd 4.55 pH 1; TEMP: 25 ° C (1) ACD
logd 5.46 pH 2; TEMP: 25 ° C (1) ACD
logd 6.33 pH 3; TEMP: 25 ° C (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
log 6.81 Ph 4; TEMP: 25 ° C. (1) ACD
log 6.91 Ph 5; TEMP: 25 ° C. (1) ACD
log 6.92 Ph 6; TEMP: 25 ° C. (1) ACD
log 6.92 Ph 7; TEMP: 25 ° C. (1) ACD
log 6.90 Ph 8; TEMP: 25 ° C. (1) ACD
log 6.77 Ph 9; TEMP: 25 ° C. (1) ACD
log 6.23 Ph 10; TEMP: 25 ° C. (1) ACD
logio 6.918 ± 0.641 TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​torfol 2.2 x 10-5 g/l TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 5.1 x 10-3 g/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 6.3 x 10-4 g/l Ph 2; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 8.2 x 10-5 g/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.8 x 10-5 g/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.2 x 10-5 g/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.2 x 10-5 g/l Ph 6; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.2 x 10-5 g/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.2 x 10-5 g/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.0 x 10-5 g/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.0 x 10-4 g/l Ph 10; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.2 x 10-5 g/l Dŵr heb ei drin pH 7.00; TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​molar 2.9 x 10-8 mol/l TEMP: 25 ° C. (1) ACD
Hydoddedd molar 6.8 x 10-6 mol/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 8.4 x 10-7 mol/l Ph 2; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 1.1 x 10-7 mol/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 3.7 x 10-8 mol/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 3.0 x 10-8 mol/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.9 x 10-8 mol/l Ph 6; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.9 x 10-8 mol/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 3.0 x 10-8 mol/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 4.0 x 10-8 mol/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 1.4 x 10-7 mol/l Ph 10; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.9 x 10-8 mol/l Dŵr heb ei drin pH 7.00; TEMP: 25 ° C. (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Pwysau moleciwlaidd 748.78    
PKA 9.39 ± 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 17   (1) ACD
H Derbynyddion 12   (1) ACD
H rhoddwyr 1   (1) ACD
H rhoddwr/derbynnydd swm 13   (1) ACD
logio 6.918 ± 0.641 TEMP: 25 ° C. (1) ACD
Pwysau moleciwlaidd 748.78    

(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 145 A2 (1) ACD

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

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

    Cynhyrchion Cysylltiedig