N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide
Chemical Structure Depiction of
N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide
N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | V010-8087 |
| Compound Name: | N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C14 H15 N3 O2 S2 |
| Salt: | not_available |
| Smiles: | CCC(Nc1nnc(SCC(c2ccc(C)cc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2165 |
| logD: | 3.215 |
| logSw: | -3.3383 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.269 |
| InChI Key: | MIRFITHCASTTNK-UHFFFAOYSA-N |