1,2-diphenyl-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1,2-diphenyl-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-one
1,2-diphenyl-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | Y020-0290 |
| Compound Name: | 1,2-diphenyl-2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C23 H16 N4 O S |
| Smiles: | c1ccc(cc1)C(C(c1ccccc1)=O)Sc1nc2c(c3ccccc3[nH]2)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7242 |
| logD: | 4.7239 |
| logSw: | -5.0325 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.002 |
| InChI Key: | IPKIAEQEURBQOR-OAQYLSRUSA-N |