N-[(5-bromo-2-methoxyphenyl)methyl]-2-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)acetamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)acetamide
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)acetamide
Compound characteristics
| Compound ID: | E228-1715 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)acetamide |
| Molecular Weight: | 458.29 |
| Molecular Formula: | C21 H17 Br F N3 O3 |
| Smiles: | COc1ccc(cc1CNC(CN1C(c2cccn2c2ccc(cc12)F)=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9241 |
| logD: | 3.9241 |
| logSw: | -4.0216 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.068 |
| InChI Key: | ZSRYSAFHNYMMSM-UHFFFAOYSA-N |