N-(5-{[(4-bromo-2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(5-{[(4-bromo-2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
N-(5-{[(4-bromo-2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | V010-3151 |
| Compound Name: | N-(5-{[(4-bromo-2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide |
| Molecular Weight: | 430.36 |
| Molecular Formula: | C16 H17 Br F N3 O S2 |
| Smiles: | C1CCC(CC1)C(Nc1nnc(SCc2ccc(cc2F)[Br])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7625 |
| logD: | 5.756 |
| logSw: | -5.714 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.156 |
| InChI Key: | RSCOBAOMIAZZLQ-UHFFFAOYSA-N |