ethyl N-(5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methylbenzene-1-sulfonyl)glycinate
Chemical Structure Depiction of
ethyl N-(5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methylbenzene-1-sulfonyl)glycinate
ethyl N-(5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methylbenzene-1-sulfonyl)glycinate
Compound characteristics
| Compound ID: | 4903-2254 |
| Compound Name: | ethyl N-(5-{4-[(2H-1,3-benzodioxol-5-yl)amino]phthalazin-1-yl}-2-methylbenzene-1-sulfonyl)glycinate |
| Molecular Weight: | 520.56 |
| Molecular Formula: | C26 H24 N4 O6 S |
| Smiles: | CCOC(CNS(c1cc(ccc1C)c1c2ccccc2c(Nc2ccc3c(c2)OCO3)nn1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5067 |
| logD: | 4.5046 |
| logSw: | -4.2418 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.065 |
| InChI Key: | NUVTZODSNKIACW-UHFFFAOYSA-N |