1-(2,5-difluorophenyl)-2-(2,5-dimethoxybenzene-1-sulfonyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Chemical Structure Depiction of
1-(2,5-difluorophenyl)-2-(2,5-dimethoxybenzene-1-sulfonyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
1-(2,5-difluorophenyl)-2-(2,5-dimethoxybenzene-1-sulfonyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Compound characteristics
Compound ID: | L844-0297 |
Compound Name: | 1-(2,5-difluorophenyl)-2-(2,5-dimethoxybenzene-1-sulfonyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole |
Molecular Weight: | 484.52 |
Molecular Formula: | C25 H22 F2 N2 O4 S |
Smiles: | COc1ccc(c(c1)S(N1CCc2c3ccccc3[nH]c2C1c1cc(ccc1F)F)(=O)=O)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 5.1878 |
logD: | 5.1878 |
logSw: | -5.4315 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.085 |
InChI Key: | CCWSNWRDAIORSN-RUZDIDTESA-N |