5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluoro-N-(2-methoxyphenyl)benzamide
Chemical Structure Depiction of
5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluoro-N-(2-methoxyphenyl)benzamide
5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluoro-N-(2-methoxyphenyl)benzamide
Compound characteristics
Compound ID: | K781-9372 |
Compound Name: | 5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluoro-N-(2-methoxyphenyl)benzamide |
Molecular Weight: | 440.49 |
Molecular Formula: | C23 H21 F N2 O4 S |
Smiles: | COc1ccccc1NC(c1cc(ccc1F)S(N1CCc2ccccc2C1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.4408 |
logD: | 4.3721 |
logSw: | -4.2522 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.635 |
InChI Key: | LMPYMSATIIMFDD-UHFFFAOYSA-N |