N-(3-chlorophenyl)-5-(4-oxo-4-{[2-(pyrrolidin-1-yl)ethyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-(4-oxo-4-{[2-(pyrrolidin-1-yl)ethyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-(4-oxo-4-{[2-(pyrrolidin-1-yl)ethyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0542 |
| Compound Name: | N-(3-chlorophenyl)-5-(4-oxo-4-{[2-(pyrrolidin-1-yl)ethyl]amino}butyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 421.95 |
| Molecular Formula: | C19 H24 Cl N5 O2 S |
| Smiles: | C(CC(NCCN1CCCC1)=O)Cc1nnc(C(Nc2cccc(c2)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.2394 |
| logD: | 0.0838 |
| logSw: | -3.4307 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.719 |
| InChI Key: | MDMHHJZQXRHWDE-UHFFFAOYSA-N |