4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(2,4-dimethylphenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(2,4-dimethylphenyl)-1,4-diazepane-1-carboxamide
4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(2,4-dimethylphenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | G797-0376 |
| Compound Name: | 4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(2,4-dimethylphenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 492.42 |
| Molecular Formula: | C25 H26 Br N5 O |
| Smiles: | Cc1ccc(c(C)c1)NC(N1CCCN(CC1)c1c2cccn2c2ccc(cc2n1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.2219 |
| logD: | 6.1392 |
| logSw: | -5.2599 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.068 |
| InChI Key: | PKXMYFVZTOIQEG-UHFFFAOYSA-N |