N-(5-{[2-(4-chloro-3-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide
Chemical Structure Depiction of
N-(5-{[2-(4-chloro-3-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide
N-(5-{[2-(4-chloro-3-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | V004-1193 |
| Compound Name: | N-(5-{[2-(4-chloro-3-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)propanamide |
| Molecular Weight: | 355.86 |
| Molecular Formula: | C14 H14 Cl N3 O2 S2 |
| Salt: | not_available |
| Smiles: | CCC(Nc1nnc(SCC(c2ccc(c(C)c2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.257 |
| logD: | 4.2556 |
| logSw: | -4.5002 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.269 |
| InChI Key: | KHDAKPNMWJEDBX-UHFFFAOYSA-N |