N-[5-({2-[4-(benzyloxy)phenyl]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-ethylhexanamide
Chemical Structure Depiction of
N-[5-({2-[4-(benzyloxy)phenyl]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-ethylhexanamide
N-[5-({2-[4-(benzyloxy)phenyl]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-ethylhexanamide
Compound characteristics
| Compound ID: | V006-9225 |
| Compound Name: | N-[5-({2-[4-(benzyloxy)phenyl]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-ethylhexanamide |
| Molecular Weight: | 483.65 |
| Molecular Formula: | C25 H29 N3 O3 S2 |
| Smiles: | CCCCC(CC)C(Nc1nnc(SCC(c2ccc(cc2)OCc2ccccc2)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5691 |
| logD: | 6.5626 |
| logSw: | -5.6963 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.71 |
| InChI Key: | QYNFUSIKVLWCQA-IBGZPJMESA-N |