2-{[5-cyclohexyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-cyclohexyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-cyclohexyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y206-0096 |
| Compound Name: | 2-{[5-cyclohexyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 280.39 |
| Molecular Formula: | C13 H20 N4 O S |
| Smiles: | C=CCn1c(C2CCCCC2)nnc1SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0921 |
| logD: | 2.0921 |
| logSw: | -2.074 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.071 |
| InChI Key: | XKYWZDJHIHHEBE-UHFFFAOYSA-N |