1-{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}-3-phenylpropan-1-one
Chemical Structure Depiction of
1-{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}-3-phenylpropan-1-one
1-{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}-3-phenylpropan-1-one
Compound characteristics
| Compound ID: | G811-0552 |
| Compound Name: | 1-{1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}-3-phenylpropan-1-one |
| Molecular Weight: | 426.58 |
| Molecular Formula: | C27 H26 N2 O S |
| Smiles: | CSc1ccc(cc1)C1c2c(CCN1C(CCc1ccccc1)=O)c1ccccc1[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.312 |
| logD: | 6.312 |
| logSw: | -5.8402 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.5442 |
| InChI Key: | VJCAXFILCXDNKA-HHHXNRCGSA-N |