N-(5-{[(2,6-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide
Chemical Structure Depiction of
N-(5-{[(2,6-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide
N-(5-{[(2,6-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide
Compound characteristics
| Compound ID: | V007-6602 |
| Compound Name: | N-(5-{[(2,6-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide |
| Molecular Weight: | 385.5 |
| Molecular Formula: | C17 H21 F2 N3 O S2 |
| Smiles: | CCCCC(CC)C(Nc1nnc(SCc2c(cccc2F)F)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8454 |
| logD: | 5.839 |
| logSw: | -5.3653 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.236 |
| InChI Key: | VYKUAZFVDBMWSD-NSHDSACASA-N |