N-(5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Chemical Structure Depiction of
N-(5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
N-(5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Compound characteristics
| Compound ID: | V005-2463 |
| Compound Name: | N-(5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide |
| Molecular Weight: | 355.86 |
| Molecular Formula: | C14 H14 Cl N3 O2 S2 |
| Salt: | not_available |
| Smiles: | CC(C)C(Nc1nnc(SCC(c2ccc(cc2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0284 |
| logD: | 4.0258 |
| logSw: | -4.4692 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.482 |
| InChI Key: | IHSCPHXLKKBCKY-UHFFFAOYSA-N |