N-(4-methoxy-2-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide
Chemical Structure Depiction of
N-(4-methoxy-2-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide
N-(4-methoxy-2-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide
Compound characteristics
| Compound ID: | Y032-3838 |
| Compound Name: | N-(4-methoxy-2-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide |
| Molecular Weight: | 378.4 |
| Molecular Formula: | C17 H18 N2 O6 S |
| Smiles: | COc1ccc(c(c1)[N+]([O-])=O)NC(CCS(Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9968 |
| logD: | 1.8287 |
| logSw: | -2.8606 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.343 |
| InChI Key: | DXRJLBPYHDGTSQ-UHFFFAOYSA-N |