N-(2-methylphenyl)-5-{[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-{[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-{[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-1112 |
| Compound Name: | N-(2-methylphenyl)-5-{[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 406.52 |
| Molecular Formula: | C18 H22 N4 O3 S2 |
| Smiles: | Cc1ccccc1NC(c1nnc(CSCC(NCC2CCCO2)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6822 |
| logD: | 1.6821 |
| logSw: | -2.3725 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.485 |
| InChI Key: | XGNMSKSQRNEJHN-CYBMUJFWSA-N |