N-[2-(3,4-diethoxyphenyl)ethyl]-2-methyl-5-[4-(3-methylanilino)phthalazin-1-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-2-methyl-5-[4-(3-methylanilino)phthalazin-1-yl]benzene-1-sulfonamide
N-[2-(3,4-diethoxyphenyl)ethyl]-2-methyl-5-[4-(3-methylanilino)phthalazin-1-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8012-7572 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-2-methyl-5-[4-(3-methylanilino)phthalazin-1-yl]benzene-1-sulfonamide |
| Molecular Weight: | 596.75 |
| Molecular Formula: | C34 H36 N4 O4 S |
| Smiles: | CCOc1ccc(CCNS(c2cc(ccc2C)c2c3ccccc3c(Nc3cccc(C)c3)nn2)(=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 6.5869 |
| logD: | 6.5851 |
| logSw: | -6.043 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.781 |
| InChI Key: | JQFUGMFDCSBGLR-UHFFFAOYSA-N |