N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-nitrobenzamide
Chemical Structure Depiction of
N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-nitrobenzamide
N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-nitrobenzamide
Compound characteristics
| Compound ID: | 1502-0551 |
| Compound Name: | N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-nitrobenzamide |
| Molecular Weight: | 373.82 |
| Molecular Formula: | C17 H12 Cl N3 O3 S |
| Smiles: | C(c1ccccc1[Cl])c1cnc(NC(c2ccccc2[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.9052 |
| logD: | 3.3655 |
| logSw: | -4.9894 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.707 |
| InChI Key: | ZANLKDFNJPMPMW-UHFFFAOYSA-N |