N-(4-chlorophenyl)-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0449 |
| Compound Name: | N-(4-chlorophenyl)-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 474 |
| Molecular Formula: | C21 H20 Cl N5 O2 S2 |
| Smiles: | C1CN(CCN1C(CSc1nnc(C(Nc2ccc(cc2)[Cl])=O)s1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.966 |
| logD: | 3.9652 |
| logSw: | -4.5271 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.576 |
| InChI Key: | MYCVUROUTHCKFS-UHFFFAOYSA-N |