N-(4-bromo-3-methylphenyl)-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
N-(4-bromo-3-methylphenyl)-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
Compound characteristics
| Compound ID: | E228-2747 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide |
| Molecular Weight: | 456.31 |
| Molecular Formula: | C22 H19 Br F N3 O2 |
| Smiles: | Cc1cc(ccc1[Br])NC(CCCN1C(c2cccn2c2ccc(cc12)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.451 |
| logD: | 4.4509 |
| logSw: | -4.2281 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.093 |
| InChI Key: | HXOZZXNUQHVJSL-UHFFFAOYSA-N |