N-(5-{[2-(3-cyanophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Chemical Structure Depiction of
N-(5-{[2-(3-cyanophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
N-(5-{[2-(3-cyanophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Compound characteristics
| Compound ID: | V001-8123 |
| Compound Name: | N-(5-{[2-(3-cyanophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide |
| Molecular Weight: | 346.43 |
| Molecular Formula: | C15 H14 N4 O2 S2 |
| Salt: | not_available |
| Smiles: | CC(C)C(Nc1nnc(SCC(c2cccc(C#N)c2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.29 |
| logD: | 3.2873 |
| logSw: | -3.6246 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.539 |
| InChI Key: | VBZYWASSWSYOIL-UHFFFAOYSA-N |