C44H53FN7O8 Guanosine8, 5 '-o- [bis (4-meteixyl]-2'-metoethropyl n, (1-metil-etil) (ATHLYL Ethyl) (ACI)
Nomer Registri CAS
144089-97-4
Properties fisik Key | Regane | Kondisi |
Bobot molekuler | 857.91 | - |
Pka (diprediksi) | 9.16 ± 0,20 | Temp paling asam: 25 ° C |
Mesem kanonik
N # cccop (oc1c (f) c (oc1coc (c = 2c = c3 = c3) c3 = c3 = c3 = c3 = c3 = c3 (c) c) n5 c (c) c) c (c) c) c (c) c
Mesem isomerat
C (OC [c @@@ h] 1 [c @@ h] (n (c) n) c (= c) n = c) (c4 = c) (c4 = c4 = c (oc) c = C4) (c5 = cc = c (oc) c = c5) c5 = c5 = cc = cc = c6
INCI
Kopi = 1s / c44h53f / C1-27 (2) 40 (53) 4-43) 47-26-51 (35-26-51 (35-26-151 (5-66) 52 (5-66) 5) 29 (5 (5 (5) 6)35(59-42)25-57-44(30-13-10-9-11-14-30,31-15-19-33(55-7)20-16-31)32-17-21-34(56-8)22-18-32/h9-11,13-22,26-29,35-36,38,42H,12, 24-25h2,1-8h3, (H2,48,49,49,49,50.54) / t35-, 36-, 38-, 42-, 61? / M1 / s1
Kunci inci
Kjfumxzzvymvymqeu-aocjbpqjsa-n
1 Jeneng liyane kanggo zat iki
Guanosine, 5 '-O- [bis (4-meteixyphenht) phenylmethyl] -2 '-deoxy-2' -fluoro-N- (2-metil-1-oxopropyl) -, 3 '- [2-Cyanoethyl BIS (1-methyl Ethyl) Phosphoramidite] (9CI)
Properties kasedhiya
Biologis
Kimia
Lipinski
Struktur sing gegandhengan
Properti | Regane | Kondisi | Sumber |
Faktor biokentrasi | 298 | PH 1; Temp: 25 ° C | (1) ACD |
Faktor biokentrasi | 6350 | PH 2; Temp: 25 ° C | (1) ACD |
Faktor biokentrasi | 57800 | PH 3; Temp: 25 ° C | (1) ACD |
Faktor biokentrasi | 1.76 x 105 | pH 4; Temp: 25 ° C | (1) ACD |
Faktor biokentrasi | 2.21 x 105 | pH 5; Temp: 25 ° C | (1) ACD |
Faktor biokentrasi | 2.26 x 105 | pH 6; Temp: 25 ° C | (1) ACD |
Faktor biokentrasi | 2.24 x 105 | pH 7; Temp: 25 ° C | (1) ACD |
Faktor biokentrasi | 2.03 x 105 | PH 8; Temp: 25 ° C | (1) ACD |
Faktor biokentrasi | 1.04 x 105 | PH 9; Temp: 25 ° C | (1) ACD |
Faktor biokentrasi | 19300 | PH 10; Temp: 25 ° C | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Sumber kondhisi properti |
KOC 312 PH 1; Temp: 25 ° C (1) ACD |
KOC 6630 PH 2; Temp: 25 ° C (1) ACD |
KOC 60400 PH 3; Temp: 25 ° C (1) ACD |
KOC 1.84 x 105 PH 4; Temp: 25 ° C (1) ACD |
KOC 2.31 x 105 PH 5; Temp: 25 ° C (1) ACD |
KOC 2.37 x 105 ph 6; Temp: 25 ° C (1) ACD |
KOC 2.35 x 105 PH 7; Temp: 25 ° C (1) ACD |
KOC 2.12 X 105 PH 8; Temp: 25 ° C (1) ACD |
KOC 1.08 x 105 PH 9; Temp: 25 ° C (1) ACD |
KOC 20200 PH 10; Temp: 25 ° C (1) ACD |
Logd 4.47 PH 1; Temp: 25 ° C (1) ACD |
Logd 5.80 pH 2; Temp: 25 ° C (1) ACD |
Properti | Regane | Kondisi | Sumber |
logd | 6.76 | PH 3; Temp: 25 ° C | (1) ACD |
logd | 7.24 | pH 4; Temp: 25 ° C | (1) ACD |
logd | 7.34 | pH 5; Temp: 25 ° C | (1) ACD |
logd | 7.35 | pH 6; Temp: 25 ° C | (1) ACD |
logd | 7.35 | pH 7; Temp: 25 ° C | (1) ACD |
logd | 7.30 | PH 8; Temp: 25 ° C | (1) ACD |
logd | 7.01 | PH 9; Temp: 25 ° C | (1) ACD |
logd | 6.28 | PH 10; Temp: 25 ° C | (1) ACD |
logp | 7.351 ± 0.713 | Temp: 25 ° C | (1) ACD |
Kelarutan Kelainan Intrinsik Massa | 3.0 x 10-5 g / l | Temp: 25 ° C | (1) ACD |
Kelarutan massa | 0,022 g / l | PH 1; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 1.0 x 10-3 g / l | PH 2; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 1.2 x 10-4 g / l | PH 3; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 3.9 x 10-5 g / l | pH 4; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 3.1 x 10-5 g / l | pH 5; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 3.0 x 10-5 g / l | pH 6; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 3.0 x 10-5 g / l | pH 7; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 3.3 x 10-5 g / l | PH 8; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 6,5 x 10-5 g / l | PH 9; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 3,5 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
Kelarutan massa | 3.0 x 10-5 g / l | Banyu banyu sing ora diluncurake 7.00; Temp: 25 ° C | (1) ACD |
Kelarutan Kelaresan Inttrinsik Molar | 3,5 x 10-8 mol / l | Temp: 25 ° C | (1) ACD |
Kelarutan molar | 2.6 x 10-5 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
Kelarutan molar | 1.2 x 10-6 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
Kelarutan molar | 1,4 x 10-7 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
Kelarutan molar | 4,5 x 10-8 mol / l | pH 4; Temp: 25 ° C | (1) ACD |
Kelarutan molar | 3.6 x 10-8 mol / l | pH 5; Temp: 25 ° C | (1) ACD |
Kelarutan molar | 3,5 x 10-8 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
Kelarutan molar | 3,5 x 10-8 mol / l | pH 7; Temp: 25 ° C | (1) ACD |
Kelarutan molar | 3.9 x 10-8 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
Kelarutan molar | 7.6 x 10-8 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
Kelarutan molar | 4.1 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
Properti | Regane | Kondisi | Sumber |
Kelarutan molar | 3,5 x 10-8 mol / l | Banyu banyu sing ora diluncurake 7.00; Temp: 25 ° C | (1) ACD |
Bobot molekuler | 857.91 | ||
PKA | 9.16 ± 0,20 | Temp paling asam: 25 ° C | (1) ACD |
PKA | 3.45 ± 070 | Umume Temp: 25 ° C | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Properti | Regane | Sumber kahanan |
Area permukaan polar | 184 A2 | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Properti | Regane | Kondisi | Sumber |
Obligasi kanthi bebas | 18 | (1) ACD | |
H Nampa | 15 | (1) ACD | |
H donor | 2 | (1) ACD | |
H Donor / Sumrah Panampa | 17 | (1) ACD | |
logp | 7.351 ± 0.713 | Temp: 25 ° C | (1) ACD |
Bobot molekuler | 857.91 |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)