2-methyl-N-[(4-methylphenyl)methyl]-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
2-methyl-N-[(4-methylphenyl)methyl]-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
2-methyl-N-[(4-methylphenyl)methyl]-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | D315-1881 |
| Compound Name: | 2-methyl-N-[(4-methylphenyl)methyl]-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C23 H25 N3 O3 S |
| Smiles: | Cc1ccc(CNS(c2cc(ccc2C)C2C3CCCCC=3C(NN=2)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0906 |
| logD: | 5.0878 |
| logSw: | -4.7298 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.308 |
| InChI Key: | HLTCZTLUURRRRW-UHFFFAOYSA-N |