4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(thiophen-2-yl)ethyl]butanamide
Chemical Structure Depiction of
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(thiophen-2-yl)ethyl]butanamide
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(thiophen-2-yl)ethyl]butanamide
Compound characteristics
| Compound ID: | E228-3099 |
| Compound Name: | 4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(thiophen-2-yl)ethyl]butanamide |
| Molecular Weight: | 458.38 |
| Molecular Formula: | C21 H20 Br N3 O2 S |
| Smiles: | C(CC(NCCc1cccs1)=O)CN1C(c2cccn2c2ccc(cc12)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4339 |
| logD: | 3.4339 |
| logSw: | -3.801 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.275 |
| InChI Key: | DNSTWJRRZGZQAD-UHFFFAOYSA-N |