| 中文别名 | KN-62(cas:127191-97-3)；CaM激酶II抑制剂；P2X7拮抗剂；KN 62；KN62 |
| 英文别名 | KN-62, CaM kinase II inhibitor(cas:127191-97-3)；P2X7 antagonist；CaM kinase II inhibitor |
| CAS号 | 127191-97-3 |
| SMILES | O=C(N1CCN(C2=CC=CC=C2)CC1)[C@H](CC3=CC=C(C=C3)OS(=O)(C4=CC=CC5=C4C=CN=C5)=O)N(C)S(=O)(C6=CC=CC7=C6C=CN=C7)=O |
| Inchi | InChI=1S/C38H35N5O6S2/c1-41(50(45,46)36-11-5-7-29-26-39-19-17-33(29)36)35(38(44)43-23-21-42(22-24-43)31-9-3-2-4-10-31)25-28-13-15-32(16-14-28)49-51(47,48)37-12-6-8-30-27-40-20-18-34(30)37/h2-20,26-27,35H,21-25H2,1H3/t35-/m0/s1 |
| InchiKey | RJVLFQBBRSMWHX-DHUJRADRSA-N |
| 分子式 Formula | C38H35N5O6S2 |
| 分子量 Molecular Weight | 721.84 |
| 闪点 FP | 537.3±37.1 ℃ |
| 沸点 Boiling point | 964.7±75.0 ℃ at 760 mmHg |
| Polarizability极化度 | 78.4±0.5 10-24cm3 |
| 密度 Density | 1.4±0.1 g/cm3 |
| 蒸汽压 Vapor Pressure | 0.0±0.3 mmHg at 25℃ |
| 溶解度Solubility | 生物体外In Vitro:DMSO溶解度≥ 100 mg/mL(138.53 mM)H2O< 0.1 mg/mL(insoluble)*"≥" 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 |
