{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(pyridin-4-yl)methanone
Chemical Structure Depiction of
{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(pyridin-4-yl)methanone
{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(pyridin-4-yl)methanone
Compound characteristics
| Compound ID: | G811-0532 |
| Compound Name: | {1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(pyridin-4-yl)methanone |
| Molecular Weight: | 399.51 |
| Molecular Formula: | C24 H21 N3 O S |
| Smiles: | CSc1ccc(cc1)C1c2c(CCN1C(c1ccncc1)=O)c1ccccc1[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5469 |
| logD: | 4.5445 |
| logSw: | -4.2486 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.5 |
| InChI Key: | WJAGHBXZCSQJNL-HSZRJFAPSA-N |