N-(5-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(5-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
N-(5-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | C301-9559 |
| Compound Name: | N-(5-{[(3-methylquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 331.42 |
| Molecular Formula: | C14 H13 N5 O S2 |
| Smiles: | CC(Nc1nnc(SCc2c(C)nc3ccccc3n2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0973 |
| logD: | 3.0962 |
| logSw: | -3.2177 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.91 |
| InChI Key: | KWVNFDUDDCGJGK-UHFFFAOYSA-N |