4-cyclohexyl-N-[1-ethyl-5-methyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-cyclohexyl-N-[1-ethyl-5-methyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]benzene-1-sulfonamide
4-cyclohexyl-N-[1-ethyl-5-methyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]benzene-1-sulfonamide
Compound characteristics
Compound ID: | C301-9408 |
Compound Name: | 4-cyclohexyl-N-[1-ethyl-5-methyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]benzene-1-sulfonamide |
Molecular Weight: | 414.53 |
Molecular Formula: | C20 H26 N6 O2 S |
Smiles: | CCn1c(C)c(c(n1)n1cnnc1)NS(c1ccc(cc1)C1CCCCC1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0313 |
logD: | -0.8678 |
logSw: | -3.2504 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.079 |
InChI Key: | VSRPOJHVVFNEBQ-UHFFFAOYSA-N |