1-(piperidin-1-yl)-2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(piperidin-1-yl)-2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one
1-(piperidin-1-yl)-2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | 8012-0649 |
| Compound Name: | 1-(piperidin-1-yl)-2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 367.47 |
| Molecular Formula: | C19 H21 N5 O S |
| Smiles: | C=CCn1c2ccccc2c2c1nc(nn2)SCC(N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1864 |
| logD: | 3.1864 |
| logSw: | -3.1248 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.349 |
| InChI Key: | SYUPNUGZYKGXGT-UHFFFAOYSA-N |