2-{[(4-fluorophenyl)methyl]sulfanyl}-1-[1-(4-fluorophenyl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl]ethan-1-one
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]sulfanyl}-1-[1-(4-fluorophenyl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl]ethan-1-one
2-{[(4-fluorophenyl)methyl]sulfanyl}-1-[1-(4-fluorophenyl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl]ethan-1-one
Compound characteristics
| Compound ID: | G811-0249 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]sulfanyl}-1-[1-(4-fluorophenyl)-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl]ethan-1-one |
| Molecular Weight: | 448.53 |
| Molecular Formula: | C26 H22 F2 N2 O S |
| Smiles: | C1CN(C(c2ccc(cc2)F)c2c1c1ccccc1[nH]2)C(CSCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6971 |
| logD: | 5.6971 |
| logSw: | -6.109 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.5442 |
| InChI Key: | OQHADESYOQZULH-AREMUKBSSA-N |