N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-nitrobenzamide
Chemical Structure Depiction of
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-nitrobenzamide
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | D335-2873 |
| Compound Name: | N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-nitrobenzamide |
| Molecular Weight: | 291.33 |
| Molecular Formula: | C13 H13 N3 O3 S |
| Smiles: | [H]N(CCc1csc(C)n1)C(c1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2471 |
| logD: | 2.247 |
| logSw: | -2.9448 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.881 |
| InChI Key: | WCJOWLHKMVSNCE-UHFFFAOYSA-N |