N-[(2,5-dimethoxyphenyl)methyl]-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
Chemical Structure Depiction of
N-[(2,5-dimethoxyphenyl)methyl]-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
N-[(2,5-dimethoxyphenyl)methyl]-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
Compound characteristics
| Compound ID: | E228-2952 |
| Compound Name: | N-[(2,5-dimethoxyphenyl)methyl]-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide |
| Molecular Weight: | 437.47 |
| Molecular Formula: | C24 H24 F N3 O4 |
| Smiles: | COc1ccc(c(CNC(CCCN2C(c3cccn3c3ccc(cc23)F)=O)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1768 |
| logD: | 3.1768 |
| logSw: | -3.4154 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.59 |
| InChI Key: | YXPZYMHZIQBUPV-UHFFFAOYSA-N |