N-(5-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3,5,5-trimethylhexanamide
Chemical Structure Depiction of
N-(5-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3,5,5-trimethylhexanamide
N-(5-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3,5,5-trimethylhexanamide
Compound characteristics
| Compound ID: | V007-6583 |
| Compound Name: | N-(5-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3,5,5-trimethylhexanamide |
| Molecular Weight: | 409.54 |
| Molecular Formula: | C19 H24 F N3 O2 S2 |
| Smiles: | CC(CC(Nc1nnc(SCC(c2ccc(cc2)F)=O)s1)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2135 |
| logD: | 5.2098 |
| logSw: | -5.0005 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.269 |
| InChI Key: | COPWXAOYKUHFPG-GFCCVEGCSA-N |