N-[2-(3,4-diethoxyphenyl)ethyl]-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
N-[2-(3,4-diethoxyphenyl)ethyl]-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
Compound characteristics
| Compound ID: | E228-2811 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-4-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide |
| Molecular Weight: | 479.55 |
| Molecular Formula: | C27 H30 F N3 O4 |
| Smiles: | CCOc1ccc(CCNC(CCCN2C(c3cccn3c3ccc(cc23)F)=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.7597 |
| logD: | 2.7597 |
| logSw: | -3.1694 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.678 |
| InChI Key: | BCWJXTCOKWKTEL-UHFFFAOYSA-N |