N-(4-chlorophenyl)-5-{[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-{[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-{[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0453 |
| Compound Name: | N-(4-chlorophenyl)-5-{[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 480.05 |
| Molecular Formula: | C21 H26 Cl N5 O2 S2 |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CSc1nnc(C(Nc2ccc(cc2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9878 |
| logD: | 3.8779 |
| logSw: | -4.4402 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.409 |
| InChI Key: | ZVICBLZTXCNBRW-UHFFFAOYSA-N |