3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-fluoro-N-(2-methylphenyl)benzamide
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-fluoro-N-(2-methylphenyl)benzamide
3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-fluoro-N-(2-methylphenyl)benzamide
Compound characteristics
Compound ID: | K781-6199 |
Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-fluoro-N-(2-methylphenyl)benzamide |
Molecular Weight: | 424.49 |
Molecular Formula: | C23 H21 F N2 O3 S |
Smiles: | Cc1ccccc1NC(c1ccc(c(c1)S(N1CCc2ccccc2C1)(=O)=O)F)=O |
Stereo: | ACHIRAL |
logP: | 4.356 |
logD: | 4.3514 |
logSw: | -4.1934 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.005 |
InChI Key: | RELYIXSIZSAKRA-UHFFFAOYSA-N |