N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-nitrobenzamide
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-2574 |
| Compound Name: | N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-nitrobenzamide |
| Molecular Weight: | 362.41 |
| Molecular Formula: | C16 H18 N4 O4 S |
| Smiles: | COc1ccc(cc1[N+]([O-])=O)C(Nc1nnc(C2CCCCC2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5893 |
| logD: | 2.1093 |
| logSw: | -3.9627 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.506 |
| InChI Key: | VWZDKXRVVQQQDH-UHFFFAOYSA-N |