5-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0459 |
| Compound Name: | 5-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 455.96 |
| Molecular Formula: | C22 H22 Cl N5 O2 S |
| Smiles: | C(Cc1nnc(C(Nc2ccccc2)=O)s1)C(N1CCN(CC1)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.37 |
| logD: | 3.37 |
| logSw: | -3.826 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.71 |
| InChI Key: | BAJQHZXVEYYPSQ-UHFFFAOYSA-N |