N-(4-methylphenyl)-5-[4-oxo-4-(propylamino)butyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-5-[4-oxo-4-(propylamino)butyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-methylphenyl)-5-[4-oxo-4-(propylamino)butyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0257 |
| Compound Name: | N-(4-methylphenyl)-5-[4-oxo-4-(propylamino)butyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 346.45 |
| Molecular Formula: | C17 H22 N4 O2 S |
| Smiles: | CCCNC(CCCc1nnc(C(Nc2ccc(C)cc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3201 |
| logD: | 2.32 |
| logSw: | -2.9509 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.642 |
| InChI Key: | WMLRZRHUKVKCNH-UHFFFAOYSA-N |