C30H29fn2O7 Uridine, 5'-O- [BIS (4-MantexyphanyL) -2'-deoxy-2'- Fluoro- (9Ci, ACI- (9Ci, ACI)
| Properties fisik Key | Regane | Kondisi |
| Bobot molekuler | 548.56 | - |
| Lelting Point (Eksperimen) | 118-120 ° C | - |
| Kapadhetan (diprediksi) | 1.38 ± 0,1 g / cm3 | Temp: 20 ° C; Pencet: 760 torr |
| Pka (diprediksi) | 9.39 ± 0,10 | Temp paling asam: 25 ° C |
Mesem kanonik o = c1c = cn (c (= o) N1) C2OC (C4 = c5 = c4) c5 = c5 = c5) c2f
Mesem isomerik c (OC @ h] 1O [C @ = c3 = c3) (oc) c5 (oc) c5 (oc) c5 = c4) c5 = c4 = c5 = c5 = c5 = c5 = c5 = c5 = c5
INCI
Kopi = 1s / c30h29fn2O7 / C1-37-222222-12-8-20 (9-13-2-3-5-5-7-19,21-10-14-23 (35-2) 39-18-21) 39-111) 28 (3-2) 28
-17-16-25 (34) 32-29 (33-2-17,24,24,24,24,24,24,24,24,24,24,24,248,35h, 18h2,1-2h3, (H, 32,34,36) / T24-, 26-, 28- / 2,-
Kunci inci
Cssfzsszxoccj-yuloidqlsa-n
1 Jeneng liyane kanggo zat iki
5'-o- [bis (4-meteixyphenyl) -2lmethyl] -2'-deoxy-2'-Fluorouridine (ACI)
Properties kasedhiya
Termal
Termal
| Properti | Regane | Kondisi | Sumber |
| Titik lebur | 118-120 ° C | (1) cas | |
(1) Penjarla, Srishylam; Nukleosida, nukléotida & asam nukleat, (2018), 37 (4), 232-247, caplus
Spektrum kasedhiya
1h nmr
13c NMR
| Properties kasedhiya |
| Biologis |
| Kimia |
| Kapadhetan |
| Lipinski |
| Struktur sing gegandhengan |
Biologis
| Properti | Regane | Kondisi | Sumber |
| Faktor biokentrasi | 3580 | PH 1; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 3580 | PH 2; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 3580 | PH 3; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 3580 | pH 4; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 3580 | pH 5; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 3580 | pH 6; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 3570 | pH 7; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 3430 | PH 8; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 2500 | PH 9; Temp: 25 ° C | (1) ACD |
| Faktor biokentrasi | 689 | PH 10; Temp: 25 ° C | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Kimia
| Properti | Regane | Kondisi | Sumber |
| Koc | 12200 | PH 1; Temp: 25 ° C | (1) ACD |
| Koc | 12200 | PH 2; Temp: 25 ° C | (1) ACD |
| Koc | 12200 | PH 3; Temp: 25 ° C | (1) ACD |
| Koc | 12200 | pH 4; Temp: 25 ° C | (1) ACD |
| Koc | 12200 | pH 5; Temp: 25 ° C | (1) ACD |
| Koc | 12200 | pH 6; Temp: 25 ° C | (1) ACD |
| Koc | 12100 | pH 7; Temp: 25 ° C | (1) ACD |
| Koc | 11700 | PH 8; Temp: 25 ° C | (1) ACD |
| Koc | 8480 | PH 9; Temp: 25 ° C | (1) ACD |
| Koc | 2340 | PH 10; Temp: 25 ° C | (1) ACD |
| logd | 4.98 | PH 1; Temp: 25 ° C | (1) ACD |
| logd | 4.98 | PH 2; Temp: 25 ° C | (1) ACD |
| logd | 4.98 | PH 3; Temp: 25 ° C | (1) ACD |
| logd | 4.98 | pH 4; Temp: 25 ° C | (1) ACD |
| logd | 4.98 | pH 5; Temp: 25 ° C | (1) ACD |
| logd | 4.98 | pH 6; Temp: 25 ° C | (1) ACD |
| logd | 4.98 | pH 7; Temp: 25 ° C | (1) ACD |
| logd | 4.96 | PH 8; Temp: 25 ° C | (1) ACD |
| logd | 4.82 | PH 9; Temp: 25 ° C | (1) ACD |
| logd | 4.26 | PH 10; Temp: 25 ° C | (1) ACD |
| logp | 4.979 ± 0,563 | Temp: 25 ° C | (1) ACD |
| Kelarutan Kelainan Intrinsik Massa | 9.9 X 10-5 g / l | Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 9.9 X 10-5 g / l | PH 1; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 9.9 X 10-5 g / l | PH 2; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 9.9 X 10-5 g / l | PH 3; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 9.9 X 10-5 g / l | pH 4; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 9.9 X 10-5 g / l | pH 5; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 9.9 X 10-5 g / l | pH 6; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 9.9 X 10-5 g / l | pH 7; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 9.9 X 10-5 g / l | PH 8; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 1,4 x 10-4 g / l | PH 9; Temp: 25 ° C | (1) ACD |
| Kelarutan massa | 5.0 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
| Properti | Regane | Kondisi | Sumber |
| Kelarutan massa | 9.9 X 10-5 g / l | Banyu banyu sing ora diluncurake 7.00; Temp: 25 ° C | (1) ACD |
| Kelarutan Kelaresan Inttrinsik Molar | 1.8 x 10-7 mol / l | Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.8 x 10-7 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.8 x 10-7 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.8 x 10-7 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.8 x 10-7 mol / l | pH 4; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.8 x 10-7 mol / l | pH 5; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.8 x 10-7 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.8 x 10-7 mol / l | pH 7; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.8 x 10-7 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 2,5 x 10-7 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 9.2 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
| Kelarutan molar | 1.8 x 10-7 mol / l | Banyu banyu sing ora diluncurake 7.00; Temp: 25 ° C | (1) ACD |
| Bobot molekuler | 548.56 | ||
| PKA | 9.39 ± 0,10 | Temp paling asam: 25 ° C | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Kapadhetan
| Properti | Regane | Kondisi | Sumber |
| Kapadhetan | 1.38 ± 0,1 g / cm3 | Temp: 20 ° C; Pencet: 760 torr | (1) ACD |
| Jilid Molar | 395.8,8 ± 5.0 cm3 / mol | Temp: 20 ° C; Pencet: 760 torr | (1) ACD |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Lipinski
| Properti | Regane | Kondisi | Sumber |
| Obligasi kanthi bebas | 10 | (1) ACD | |
| H Nampa | 9 | (1) ACD | |
| H donor | 2 | (1) ACD | |
| H Donor / Sumrah Panampa | 11 | (1) ACD | |
| logp | 4.979 ± 0,563 | Temp: 25 ° C | (1) ACD |
| Bobot molekuler | 548.56 |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Struktur sing gegandhengan
| Properti | Regane | Kondisi | Sumber |
| Area permukaan polar | 107 A2 | (1) ACD | |
(1) Diitung nggunakake piranti lunak kimia majeng (ACD / Labs) v11.02 (© 1994-2023 ACD / Lab)
Spektrum kasedhiya
1h nmr
13c NMR
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