5-chloro-2-methoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Chemical Structure Depiction of
5-chloro-2-methoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
5-chloro-2-methoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | Y032-1255 |
| Compound Name: | 5-chloro-2-methoxy-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide |
| Molecular Weight: | 363.78 |
| Molecular Formula: | C15 H10 Cl N3 O4 S |
| Smiles: | COc1ccc(cc1C(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4466 |
| logD: | 4.1779 |
| logSw: | -4.7666 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.103 |
| InChI Key: | NBNXTBYCPJUMGW-UHFFFAOYSA-N |