N-(2-methoxy-4-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide
Chemical Structure Depiction of
N-(2-methoxy-4-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide
N-(2-methoxy-4-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide
Compound characteristics
Compound ID: | Y032-3845 |
Compound Name: | N-(2-methoxy-4-nitrophenyl)-3-(phenylmethanesulfonyl)propanamide |
Molecular Weight: | 378.4 |
Molecular Formula: | C17 H18 N2 O6 S |
Smiles: | COc1cc(ccc1NC(CCS(Cc1ccccc1)(=O)=O)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 1.6678 |
logD: | 1.4247 |
logSw: | -2.5642 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 91.731 |
InChI Key: | NREBUPMRJVYYQC-UHFFFAOYSA-N |