N-[5-(1,3-benzothiazol-2-yl)-2,4-dichlorophenyl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[5-(1,3-benzothiazol-2-yl)-2,4-dichlorophenyl]-4-nitrobenzamide
N-[5-(1,3-benzothiazol-2-yl)-2,4-dichlorophenyl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | 8188-0902 |
| Compound Name: | N-[5-(1,3-benzothiazol-2-yl)-2,4-dichlorophenyl]-4-nitrobenzamide |
| Molecular Weight: | 444.29 |
| Molecular Formula: | C20 H11 Cl2 N3 O3 S |
| Smiles: | c1ccc2c(c1)nc(c1cc(c(cc1[Cl])[Cl])NC(c1ccc(cc1)[N+]([O-])=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 6.3568 |
| logD: | 6.2267 |
| logSw: | -6.5068 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.462 |
| InChI Key: | TYWQIEPWPAQXIM-UHFFFAOYSA-N |