5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methyl-N-[(oxolan-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-[(oxolan-2-yl)methyl]benzene-1-sulfonamide
5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methyl-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4903-2176 |
| Compound Name: | 5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methyl-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 518.59 |
| Molecular Formula: | C27 H26 N4 O5 S |
| Smiles: | Cc1ccc(cc1S(NCC1CCCO1)(=O)=O)c1c2ccccc2c(Nc2ccc3c(c2)OCO3)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5106 |
| logD: | 4.5102 |
| logSw: | -4.3284 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.289 |
| InChI Key: | ZSASFHBLTAYLFZ-HXUWFJFHSA-N |