5-({[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-({[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-({[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0730 |
| Compound Name: | 5-({[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 362.47 |
| Molecular Formula: | C16 H18 N4 O2 S2 |
| Smiles: | C1CCN(C1)C(CSCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3401 |
| logD: | 2.34 |
| logSw: | -2.7725 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.816 |
| InChI Key: | YPUXBYQZYUQUDZ-UHFFFAOYSA-N |