N-(5-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)hexanamide
Chemical Structure Depiction of
N-(5-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)hexanamide
N-(5-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)hexanamide
Compound characteristics
| Compound ID: | V008-0038 |
| Compound Name: | N-(5-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)hexanamide |
| Molecular Weight: | 377.53 |
| Molecular Formula: | C18 H23 N3 O2 S2 |
| Smiles: | CCCCCC(Nc1nnc(SCC(c2ccc(C)cc2C)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2775 |
| logD: | 5.2752 |
| logSw: | -4.9751 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.269 |
| InChI Key: | DALXOVINZGLZSS-UHFFFAOYSA-N |