N-(4-chlorophenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)propyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)propyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)propyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0549 |
| Compound Name: | N-(4-chlorophenyl)-5-[(2-oxo-2-{[3-(pyrrolidin-1-yl)propyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 439.98 |
| Molecular Formula: | C18 H22 Cl N5 O2 S2 |
| Smiles: | C1CCN(C1)CCCNC(CSc1nnc(C(Nc2ccc(cc2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5285 |
| logD: | -0.562 |
| logSw: | -3.3455 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.585 |
| InChI Key: | ZEPVTNGKJKVQIP-UHFFFAOYSA-N |