N-[(3-bromophenyl)methyl]-3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)propanamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)propanamide
N-[(3-bromophenyl)methyl]-3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)propanamide
Compound characteristics
| Compound ID: | E228-2559 |
| Compound Name: | N-[(3-bromophenyl)methyl]-3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)propanamide |
| Molecular Weight: | 442.29 |
| Molecular Formula: | C21 H17 Br F N3 O2 |
| Smiles: | C(CN1C(c2cccn2c2ccc(cc12)F)=O)C(NCc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9828 |
| logD: | 3.9828 |
| logSw: | -4.1214 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.416 |
| InChI Key: | MYDBXXMVPYLDDV-UHFFFAOYSA-N |