N-[2-methoxy-5-(trifluoromethyl)phenyl]-3-nitro-4-(phenylsulfanyl)benzamide
Chemical Structure Depiction of
N-[2-methoxy-5-(trifluoromethyl)phenyl]-3-nitro-4-(phenylsulfanyl)benzamide
N-[2-methoxy-5-(trifluoromethyl)phenyl]-3-nitro-4-(phenylsulfanyl)benzamide
Compound characteristics
| Compound ID: | 8014-5101 |
| Compound Name: | N-[2-methoxy-5-(trifluoromethyl)phenyl]-3-nitro-4-(phenylsulfanyl)benzamide |
| Molecular Weight: | 448.42 |
| Molecular Formula: | C21 H15 F3 N2 O4 S |
| Smiles: | COc1ccc(cc1NC(c1ccc(c(c1)[N+]([O-])=O)Sc1ccccc1)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.0073 |
| logD: | 4.9087 |
| logSw: | -5.6913 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.071 |
| InChI Key: | KPVFQXVCDLHCAR-UHFFFAOYSA-N |