N-(4-bromo-2-fluorophenyl)-4-(7-chloropyrrolo[1,2-a]quinoxalin-4-yl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-4-(7-chloropyrrolo[1,2-a]quinoxalin-4-yl)-1,4-diazepane-1-carboxamide
N-(4-bromo-2-fluorophenyl)-4-(7-chloropyrrolo[1,2-a]quinoxalin-4-yl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | G797-0451 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-4-(7-chloropyrrolo[1,2-a]quinoxalin-4-yl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 516.8 |
| Molecular Formula: | C23 H20 Br Cl F N5 O |
| Smiles: | C1CN(CCN(C1)c1c2cccn2c2ccc(cc2n1)[Cl])C(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.3182 |
| logD: | 6.2494 |
| logSw: | -6.3233 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.068 |
| InChI Key: | XELVFOSKEHUYJK-UHFFFAOYSA-N |