4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}butanamide
Chemical Structure Depiction of
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}butanamide
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}butanamide
Compound characteristics
| Compound ID: | E228-3102 |
| Compound Name: | 4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}butanamide |
| Molecular Weight: | 498.44 |
| Molecular Formula: | C24 H24 Br N3 O2 S |
| Smiles: | CSc1ccc(CCNC(CCCN2C(c3cccn3c3ccc(cc23)[Br])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1942 |
| logD: | 4.1942 |
| logSw: | -4.1841 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.257 |
| InChI Key: | YLVBRGALUUWJSU-UHFFFAOYSA-N |