4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(2,4-difluorophenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(2,4-difluorophenyl)-1,4-diazepane-1-carboxamide
4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(2,4-difluorophenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | G797-0398 |
| Compound Name: | 4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(2,4-difluorophenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 500.34 |
| Molecular Formula: | C23 H20 Br F2 N5 O |
| Smiles: | C1CN(CCN(C1)c1c2cccn2c2ccc(cc2n1)[Br])C(Nc1ccc(cc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6552 |
| logD: | 5.572 |
| logSw: | -5.7269 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.068 |
| InChI Key: | CPIFSMBVYPSTGH-UHFFFAOYSA-N |