N-(3-chloro-4-methylphenyl)-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
N-(3-chloro-4-methylphenyl)-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | D315-1892 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide |
| Molecular Weight: | 443.95 |
| Molecular Formula: | C22 H22 Cl N3 O3 S |
| Smiles: | Cc1ccc(cc1S(Nc1ccc(C)c(c1)[Cl])(=O)=O)C1C2CCCCC=2C(NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1304 |
| logD: | 4.8154 |
| logSw: | -6.1284 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.2 |
| InChI Key: | KCJGXKZYZYPKCG-UHFFFAOYSA-N |