5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methyl-N-[(pyridin-2-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methyl-N-[(pyridin-2-yl)methyl]benzene-1-sulfonamide
5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methyl-N-[(pyridin-2-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8012-5764 |
| Compound Name: | 5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methyl-N-[(pyridin-2-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 525.59 |
| Molecular Formula: | C28 H23 N5 O4 S |
| Smiles: | Cc1ccc(cc1S(NCc1ccccn1)(=O)=O)c1c2ccccc2c(Nc2ccc3c(c2)OCO3)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.8286 |
| logD: | 4.8152 |
| logSw: | -4.7869 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.178 |
| InChI Key: | OAYRPRZDRMUESX-UHFFFAOYSA-N |