1-({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide
1-({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y020-7756 |
| Compound Name: | 1-({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C18 H22 N6 O2 S |
| Smiles: | C=CCn1c(c2cccnc2)nnc1SCC(N1CCC(CC1)C(N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2031 |
| logD: | 0.1906 |
| logSw: | -1.0445 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.188 |
| InChI Key: | RBVOARGLBXAGEU-UHFFFAOYSA-N |