Ffôn: 86-512-52678575
C47H51FN7O7P Adenosine, N-Benzoyl-5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′-deoxy-2 ′ -fluoro-, 3 ′-[2-cyanoethyl amffor n, ne-bis (ac-bis

nghynnyrch

C47H51FN7O7P Adenosine, N-Benzoyl-5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′-deoxy-2 ′ -fluoro-, 3 ′-[2-cyanoethyl amphyled (acc)
  • C47H51FN7O7P Adenosine, N-Benzoyl-5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′-deoxy-2 ′ -fluoro-, 3 ′-[2-cyanoethyl amffor n, ne-bis (ac-bis

C47H51FN7O7P Adenosine, N-Benzoyl-5 ′ -o- [bis (4-methoxyphenyl) phenylmethyl] -2 ′-deoxy-2 ′ -fluoro-, 3 ′-[2-cyanoethyl amffor n, ne-bis (ac-bis

Gwybodaeth Sylfaenol:


Manylion y Cynnyrch

Tagiau cynnyrch

Manylion Sylweddau

Rhif Cofrestrfa CAS

136834-22-5

Priodweddau Ffisegol Allweddol Gwerthfawrogom Cyflyrasoch
Pwysau moleciwlaidd 875.92 -
PKA (a ragwelir) 7.87 ± 0.43 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 = NC = NC = 6C (= NC) = NC) n (c (c (c (c (c (c (c

Gwenau isomerig

C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](F)[C@@H](O1)N2C=3C(N=C2)=C(NC(=O)C4=CC=CC=C4)N=CN3)(C5=CC=C (OC) C = C5) (C6 = CC = C (OC) C = C6) C7 = CC = CC = C7

Inchi

Inchi = 1S/C47H51FN7O7P/C1-31 (2) 55 (32 (3) 4) 63 (60-27-13-26-49) 62-42-39 (61-46 (40 (42) 48) 54-30-52-41-41-43 (50-43 ( . 2,46H, 13,27-28H2,1-6H3, (H, 50,51,53,56)/T39-, 40-, 42-, 46-, 63?/M1/S1

Allwedd inchi

Vccmvpdslhfcbb-msirfhfksa-n

1 enw arall ar y sylwedd hwn

Adenosine,N-Benzoyl -5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′ -deoxy-2 ′ -fluoro-, 3 ′-[2-cyanoethyl bis (1-methylethyl) ffosffor amidite] (9ci) (9ci)

Eiddo a ragwelir

Eiddo ar gael
Biolegol
Gemegol
Lipinski
Strwythur yn gysylltiedig

Biolegol

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Ffactor Bio -ganolbwynt 6590 Ph 1; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.76 x 105 Ph 2; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.00 x 106 Ph 3; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.00 x 106 Ph 4; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.00 x 106 Ph 5; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.00 x 106 Ph 6; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.00 x 106 Ph 7; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 1.00 x 106 Ph 8; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 3.43 x 105 Ph 9; TEMP: 25 ° C. (1) ACD
Ffactor Bio -ganolbwynt 99100 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 2590 pH 1; TEMP: 25 ° C (1) ACD
KOC 69100 pH 2; TEMP: 25 ° C (1) ACD
KOC 6.96 x 105 pH 3; TEMP: 25 ° C (1) ACD
KOC 2.16 x 106 pH 4; TEMP: 25 ° C (1) ACD
KOC 2.70 x 106 pH 5; TEMP: 25 ° C (1) ACD
KOC 2.71 x 106 pH 6; TEMP: 25 ° C (1) ACD
KOC 2.23 x 106 pH 7; TEMP: 25 ° C (1) ACD
Koc 8.20 x 105 pH 8; TEMP: 25 ° C (1) ACD
KOC 1.35 x 105 pH 9; TEMP: 25 ° C (1) ACD
KOC 39000 pH 10; TEMP: 25 ° C (1) ACD
logd 6.29 pH 1; TEMP: 25 ° C (1) ACD
logd 7.71 pH 2; TEMP: 25 ° C (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
log 8.71 Ph 3; TEMP: 25 ° C. (1) ACD
log 9.20 Ph 4; TEMP: 25 ° C. (1) ACD
log 9.30 Ph 5; TEMP: 25 ° C. (1) ACD
log 9.30 Ph 6; TEMP: 25 ° C. (1) ACD
log 9.22 Ph 7; TEMP: 25 ° C. (1) ACD
log 8.79 Ph 8; TEMP: 25 ° C. (1) ACD
log 8.00 Ph 9; TEMP: 25 ° C. (1) ACD
log 7.46 Ph 10; TEMP: 25 ° C. (1) ACD
logio 9.317 ± 0.714 TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​torfol 3.4 x 10-6 g/l TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.6 x 10-3 g/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.3 x 10-4 g/l Ph 2; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.3 x 10-5 g/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 4.3 x 10-6 g/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.4 x 10-6 g/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 3.4 x 10-6 g/l Ph 6; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 4.1 x 10-6 g/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 1.1 x 10-5 g/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 6.9 x 10-5 g/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 2.5 x 10-4 g/l Ph 10; TEMP: 25 ° C. (1) ACD
Hydoddedd torfol 4.1 x 10-6 g/l Dŵr heb ei drin pH 7.00; TEMP: 25 ° C. (1) ACD
Hydoddedd cynhenid ​​molar 3.9 x 10-9 mol/l TEMP: 25 ° C. (1) ACD
Hydoddedd molar 4.1 x 10-6 mol/l Ph 1; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 1.5 x 10-7 mol/l Ph 2; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 1.5 x 10-8 mol/l Ph 3; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 4.9 x 10-9 mol/l Ph 4; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 3.9 x 10-9 mol/l Ph 5; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 3.9 x 10-9 mol/l Ph 6; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 4.7 x 10-9 mol/l Ph 7; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 1.3 x 10-8 mol/l Ph 8; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 7.9 x 10-8 mol/l Ph 9; TEMP: 25 ° C. (1) ACD
Hydoddedd molar 2.8 x 10-7 mol/l Ph 10; TEMP: 25 ° C. (1) ACD

 

Eiddo Gwerthfawrogom Cyflyrasoch Ffynhonnell
Hydoddedd molar 4.7 x 10-9 mol/l Dŵr heb ei drin pH 7.00; TEMP: 25 ° C. (1) ACD
Pwysau moleciwlaidd 875.92    
PKA 7.87 ± 0.43 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 18   (1) ACD
H Derbynyddion 14   (1) ACD
H rhoddwyr 1   (1) ACD
H rhoddwr/derbynnydd swm 15   (1) ACD
logio 9.317 ± 0.714 TEMP: 25 ° C. (1) ACD
Pwysau moleciwlaidd 875.92    

(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 169 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