N-(2-methylphenyl)-5-[4-oxo-4-(pyrrolidin-1-yl)butyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-[4-oxo-4-(pyrrolidin-1-yl)butyl]-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-[4-oxo-4-(pyrrolidin-1-yl)butyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0834 |
| Compound Name: | N-(2-methylphenyl)-5-[4-oxo-4-(pyrrolidin-1-yl)butyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 358.46 |
| Molecular Formula: | C18 H22 N4 O2 S |
| Smiles: | Cc1ccccc1NC(c1nnc(CCCC(N2CCCC2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3093 |
| logD: | 2.3092 |
| logSw: | -2.6872 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.118 |
| InChI Key: | ZMZKHLPCLAHBMN-UHFFFAOYSA-N |