N-cyclopentyl-2-{[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-cyclopentyl-2-{[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-cyclopentyl-2-{[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | 8012-5439 |
Compound Name: | N-cyclopentyl-2-{[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
Molecular Weight: | 343.45 |
Molecular Formula: | C17 H21 N5 O S |
Smiles: | C=CCn1c(c2cccnc2)nnc1SCC(NC1CCCC1)=O |
Stereo: | ACHIRAL |
logP: | 2.0012 |
logD: | 1.9887 |
logSw: | -1.8225 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.3 |
InChI Key: | WIOKITOCKQNJPY-UHFFFAOYSA-N |