N-(2-methylphenyl)-5-({[2-oxo-2-(propylamino)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-({[2-oxo-2-(propylamino)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-({[2-oxo-2-(propylamino)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-1101 |
| Compound Name: | N-(2-methylphenyl)-5-({[2-oxo-2-(propylamino)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 364.49 |
| Molecular Formula: | C16 H20 N4 O2 S2 |
| Smiles: | CCCNC(CSCc1nnc(C(Nc2ccccc2C)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2937 |
| logD: | 2.2936 |
| logSw: | -2.6389 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.944 |
| InChI Key: | KWILKIQQMYUKMM-UHFFFAOYSA-N |