1-(morpholin-4-yl)-2-{[5-(2-phenylethyl)-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-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one
1-(morpholin-4-yl)-2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | 8012-0651 |
| Compound Name: | 1-(morpholin-4-yl)-2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C23 H23 N5 O2 S |
| Smiles: | C(Cn1c2ccccc2c2c1nc(nn2)SCC(N1CCOCC1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1295 |
| logD: | 3.1295 |
| logSw: | -3.1389 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.986 |
| InChI Key: | ZNYOWJOUGIHUKZ-UHFFFAOYSA-N |