2-methyl-5-[4-(4-methylanilino)phthalazin-1-yl]-N-(2-methylbut-3-yn-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
2-methyl-5-[4-(4-methylanilino)phthalazin-1-yl]-N-(2-methylbut-3-yn-2-yl)benzene-1-sulfonamide
2-methyl-5-[4-(4-methylanilino)phthalazin-1-yl]-N-(2-methylbut-3-yn-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8012-0375 |
| Compound Name: | 2-methyl-5-[4-(4-methylanilino)phthalazin-1-yl]-N-(2-methylbut-3-yn-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 470.59 |
| Molecular Formula: | C27 H26 N4 O2 S |
| Smiles: | Cc1ccc(cc1)Nc1c2ccccc2c(c2ccc(C)c(c2)S(NC(C)(C)C#C)(=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 5.471 |
| logD: | 5.4701 |
| logSw: | -5.7683 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.295 |
| InChI Key: | SULJKCRXOXXMBX-UHFFFAOYSA-N |