4-(piperidin-1-yl)-6-({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-(piperidin-1-yl)-6-({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3,5-triazin-2-amine
4-(piperidin-1-yl)-6-({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | 8013-1734 |
| Compound Name: | 4-(piperidin-1-yl)-6-({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3,5-triazin-2-amine |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C19 H23 N9 S |
| Smiles: | C=CCn1c(c2cccnc2)nnc1SCc1nc(N)nc(n1)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.7372 |
| logD: | 2.7247 |
| logSw: | -2.6694 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.439 |
| InChI Key: | GCWAKBUSJTYDMI-UHFFFAOYSA-N |