5-{[(2-oxo-2-{[(pyridin-3-yl)methyl]amino}ethyl)sulfanyl]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(2-oxo-2-{[(pyridin-3-yl)methyl]amino}ethyl)sulfanyl]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-{[(2-oxo-2-{[(pyridin-3-yl)methyl]amino}ethyl)sulfanyl]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0688 |
| Compound Name: | 5-{[(2-oxo-2-{[(pyridin-3-yl)methyl]amino}ethyl)sulfanyl]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C18 H17 N5 O2 S2 |
| Smiles: | C(c1cccnc1)NC(CSCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8142 |
| logD: | 1.8117 |
| logSw: | -1.8348 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.047 |
| InChI Key: | OFIBJTQURGZTAU-UHFFFAOYSA-N |