3-(2-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide
3-(2-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide
Compound characteristics
| Compound ID: | Y032-1224 |
| Compound Name: | 3-(2-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)prop-2-enamide |
| Molecular Weight: | 359.79 |
| Molecular Formula: | C16 H10 Cl N3 O3 S |
| Smiles: | C(=C/c1ccccc1[Cl])\C(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0695 |
| logD: | 5.0688 |
| logSw: | -5.4968 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.259 |
| InChI Key: | CQGFSLMRKPPDJE-UHFFFAOYSA-N |