{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(phenyl)methanone
Chemical Structure Depiction of
{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(phenyl)methanone
{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | G811-0592 |
| Compound Name: | {1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(phenyl)methanone |
| Molecular Weight: | 398.53 |
| Molecular Formula: | C25 H22 N2 O S |
| Smiles: | CSc1ccc(cc1)C1c2c(CCN1C(c1ccccc1)=O)c1ccccc1[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6909 |
| logD: | 5.6909 |
| logSw: | -5.8913 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.0715 |
| InChI Key: | RHJDVJGSJAGWMO-XMMPIXPASA-N |