4-chloro-3-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide
Chemical Structure Depiction of
4-chloro-3-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide
4-chloro-3-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | Y032-2536 |
| Compound Name: | 4-chloro-3-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide |
| Molecular Weight: | 337.78 |
| Molecular Formula: | C14 H12 Cl N3 O3 S |
| Smiles: | C1CCc2c(C1)nc(NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.9943 |
| logD: | 1.1402 |
| logSw: | -4.5481 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.878 |
| InChI Key: | VQHSFKGUMJLPIB-UHFFFAOYSA-N |