N-cyclopentyl-2-({4-ethyl-5-[1-methyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-cyclopentyl-2-({4-ethyl-5-[1-methyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-cyclopentyl-2-({4-ethyl-5-[1-methyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
Compound ID: | L849-1272 |
Compound Name: | N-cyclopentyl-2-({4-ethyl-5-[1-methyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
Molecular Weight: | 424.57 |
Molecular Formula: | C22 H28 N6 O S |
Smiles: | CCn1c(c2cn(C)nc2c2ccc(C)cc2)nnc1SCC(NC1CCCC1)=O |
Stereo: | ACHIRAL |
logP: | 3.3161 |
logD: | 3.3161 |
logSw: | -3.5619 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.612 |
InChI Key: | QDLQXGHBUUJUHI-UHFFFAOYSA-N |