N-(2,5-dimethoxyphenyl)-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
N-(2,5-dimethoxyphenyl)-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
Compound characteristics
| Compound ID: | E228-2727 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide |
| Molecular Weight: | 423.44 |
| Molecular Formula: | C23 H22 F N3 O4 |
| Smiles: | COc1ccc(c(c1)NC(CCCN1C(c2cccn2c2ccc(cc12)F)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9599 |
| logD: | 2.959 |
| logSw: | -3.5034 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.57 |
| InChI Key: | TVPWHMLHVTUEKJ-UHFFFAOYSA-N |