N-[2-(3,4-diethoxyphenyl)ethyl]-5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
N-[2-(3,4-diethoxyphenyl)ethyl]-5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide
Compound characteristics
Compound ID: | 8012-7578 |
Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonamide |
Molecular Weight: | 610.78 |
Molecular Formula: | C35 H38 N4 O4 S |
Smiles: | CCOc1ccc(CCNS(c2cc(ccc2C)c2c3ccccc3c(Nc3ccc(C)cc3C)nn2)(=O)=O)cc1OCC |
Stereo: | ACHIRAL |
logP: | 7.0264 |
logD: | 7.0255 |
logSw: | -5.954 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 87.083 |
InChI Key: | PHVBCNGZNYDBAU-UHFFFAOYSA-N |