N-(4-chlorophenyl)-5-[(2-oxo-2-{[3-(4-propylpiperazin-1-yl)propyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-[(2-oxo-2-{[3-(4-propylpiperazin-1-yl)propyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-[(2-oxo-2-{[3-(4-propylpiperazin-1-yl)propyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0559 |
| Compound Name: | N-(4-chlorophenyl)-5-[(2-oxo-2-{[3-(4-propylpiperazin-1-yl)propyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 497.08 |
| Molecular Formula: | C21 H29 Cl N6 O2 S2 |
| Smiles: | CCCN1CCN(CCCNC(CSc2nnc(C(Nc3ccc(cc3)[Cl])=O)s2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.5113 |
| logD: | 1.5466 |
| logSw: | -3.3201 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.009 |
| InChI Key: | SXXGCHOHZXBBRQ-UHFFFAOYSA-N |