3-{[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}-5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}-5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazole
3-{[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}-5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazole
Compound characteristics
Compound ID: | 8017-3905 |
Compound Name: | 3-{[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}-5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazole |
Molecular Weight: | 422.57 |
Molecular Formula: | C22 H22 N4 O S2 |
Smiles: | C1CCC(CC1)c1nc(CSc2nnc(c3ccco3)n2c2ccccc2)cs1 |
Stereo: | ACHIRAL |
logP: | 5.6132 |
logD: | 5.6131 |
logSw: | -5.73 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 43.712 |
InChI Key: | WAACTSHGSOWSDM-UHFFFAOYSA-N |