N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-ethoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-ethoxy-3-nitrobenzamide
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-ethoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | 7840-2813 |
| Compound Name: | N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-ethoxy-3-nitrobenzamide |
| Molecular Weight: | 433.48 |
| Molecular Formula: | C23 H19 N3 O4 S |
| Smiles: | CCOc1ccc(cc1[N+]([O-])=O)C(Nc1ccc(cc1C)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1834 |
| logD: | 5.1831 |
| logSw: | -5.0227 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.371 |
| InChI Key: | YPABUCOXMHRZKM-UHFFFAOYSA-N |