| CAS NO: | 586368-06-1 |
| 中文别名 | Olcegepant hydrochloride(cas:586368-06-1) |
| 英文别名 | Olcegepant hydrochloride,586368-06-1 |
| CAS号 | 586368-06-1 |
| SMILES | O=C1N(CC2=C(N1)C=CC=C2)C3CCN(C(N[C@@H](C(N[C@H](C(N4CCN(C5=CC=NC=C5)CC4)=O)CCCCN)=O)CC6=CC(Br)=C(C(Br)=C6)O)=O)CC3.Cl |
| Inchi | InChI=1S/C38H47Br2N9O5.ClH/c39-29-21-25(22-30(40)34(29)50)23-33(45-37(53)48-15-10-28(11-16-48)49-24-26-5-1-2-6-31(26)44-38(49)54)35(51)43-32(7-3-4-12-41)36(52)47-19-17-46(18-20-47)27-8-13-42-14-9-27;/h1-2,5-6,8-9,13-14,21-22,28,32-33,50H,3-4,7,10-12,15-20,23-24,41H2,(H,43,51)(H,44,54)(H,45,53);1H/t32-,33+;/m0./s1 |
| InchiKey | GJAWDDNZNYEKMO-XWIRJDCTSA-N |
| 分子式 Formula | C38H47Br2N9O5.HCl |
| 分子量 Molecular Weight | 906.11 |
| 溶解度Solubility | 生物体外In Vitro:H2O≥ 66.66 mg/mL(73.57 mM)*"≥" means soluble可溶, but saturation unknown溶解度未知. |
| 性状 | 固体粉末,Power |
| 储藏条件 Storage conditions | -20℃ 3 years年 4℃ 2 years年 / In solvent溶液中:-80℃ 6 months月 -20℃ 1 month月 |
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