N-(5-{[(3-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide
Chemical Structure Depiction of
N-(5-{[(3-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide
N-(5-{[(3-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide
Compound characteristics
| Compound ID: | V007-6582 |
| Compound Name: | N-(5-{[(3-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide |
| Molecular Weight: | 383.96 |
| Molecular Formula: | C17 H22 Cl N3 O S2 |
| Smiles: | CCCCC(CC)C(Nc1nnc(SCc2cccc(c2)[Cl])s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.285 |
| logD: | 6.2786 |
| logSw: | -6.0867 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.236 |
| InChI Key: | LBLRPPFNISQSFT-ZDUSSCGKSA-N |