3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | E228-2641 |
| Compound Name: | 3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide |
| Molecular Weight: | 409.48 |
| Molecular Formula: | C22 H20 F N3 O2 S |
| Smiles: | CSc1ccc(CNC(CCN2C(c3cccn3c3ccc(cc23)F)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9492 |
| logD: | 3.9492 |
| logSw: | -3.9894 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.416 |
| InChI Key: | NVTFZGYMOKAEPZ-UHFFFAOYSA-N |