4-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-nitrobenzamide
4-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-1533 |
| Compound Name: | 4-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-nitrobenzamide |
| Molecular Weight: | 423.88 |
| Molecular Formula: | C21 H14 Cl N3 O3 S |
| Smiles: | Cc1ccc2c(c1)sc(c1ccc(cc1)NC(c1ccc(cc1[N+]([O-])=O)[Cl])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.8157 |
| logD: | 5.7588 |
| logSw: | -5.89 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.859 |
| InChI Key: | WAZWDAJYCMWJJR-UHFFFAOYSA-N |