1-(morpholin-4-yl)-2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(morpholin-4-yl)-2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one
1-(morpholin-4-yl)-2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | 8012-0632 |
| Compound Name: | 1-(morpholin-4-yl)-2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 371.46 |
| Molecular Formula: | C18 H21 N5 O2 S |
| Smiles: | CC(C)n1c2ccccc2c2c1nc(nn2)SCC(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9373 |
| logD: | 1.9373 |
| logSw: | -2.2988 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.355 |
| InChI Key: | CCDBWJCPLRANDH-UHFFFAOYSA-N |