N-(2-methoxy-5-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide
N-(2-methoxy-5-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide
Compound characteristics
| Compound ID: | Y032-3839 |
| Compound Name: | N-(2-methoxy-5-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide |
| Molecular Weight: | 378.4 |
| Molecular Formula: | C17 H18 N2 O6 S |
| Smiles: | COc1ccc(cc1NC(CCS(Cc1ccccc1)(=O)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.4438 |
| logD: | 1.3081 |
| logSw: | -2.4764 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.731 |
| InChI Key: | JOJTWFOUTRMNTN-UHFFFAOYSA-N |