N-(3-chlorophenyl)-5-[4-(2-oxo-2-{[2-(pyrrolidin-1-yl)ethyl]amino}ethyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[4-(2-oxo-2-{[2-(pyrrolidin-1-yl)ethyl]amino}ethyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[4-(2-oxo-2-{[2-(pyrrolidin-1-yl)ethyl]amino}ethyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F865-0502 |
| Compound Name: | N-(3-chlorophenyl)-5-[4-(2-oxo-2-{[2-(pyrrolidin-1-yl)ethyl]amino}ethyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 505.04 |
| Molecular Formula: | C23 H29 Cl N6 O3 S |
| Smiles: | C1CCN(C1)CCNC(CC1CCN(CC1)C(c1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4043 |
| logD: | 0.2487 |
| logSw: | -3.4132 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.872 |
| InChI Key: | SMHYMDNKUADYNT-UHFFFAOYSA-N |