(3,4-dimethoxyphenyl){1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}methanone
Chemical Structure Depiction of
(3,4-dimethoxyphenyl){1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}methanone
(3,4-dimethoxyphenyl){1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}methanone
Compound characteristics
| Compound ID: | G811-0525 |
| Compound Name: | (3,4-dimethoxyphenyl){1-[4-(methylsulfanyl)phenyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}methanone |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C27 H26 N2 O3 S |
| Smiles: | COc1ccc(cc1OC)C(N1CCc2c3ccccc3[nH]c2C1c1ccc(cc1)SC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3361 |
| logD: | 5.3361 |
| logSw: | -5.7481 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.332 |
| InChI Key: | KSBUHMJWWHHMIZ-AREMUKBSSA-N |