ethyl N-(2-methyl-5-{4-[3-(trifluoromethyl)anilino]phthalazin-1-yl}benzene-1-sulfonyl)glycinate
Chemical Structure Depiction of
ethyl N-(2-methyl-5-{4-[3-(trifluoromethyl)anilino]phthalazin-1-yl}benzene-1-sulfonyl)glycinate
ethyl N-(2-methyl-5-{4-[3-(trifluoromethyl)anilino]phthalazin-1-yl}benzene-1-sulfonyl)glycinate
Compound characteristics
| Compound ID: | 4903-2253 |
| Compound Name: | ethyl N-(2-methyl-5-{4-[3-(trifluoromethyl)anilino]phthalazin-1-yl}benzene-1-sulfonyl)glycinate |
| Molecular Weight: | 544.55 |
| Molecular Formula: | C26 H23 F3 N4 O4 S |
| Smiles: | CCOC(CNS(c1cc(ccc1C)c1c2ccccc2c(Nc2cccc(c2)C(F)(F)F)nn1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7168 |
| logD: | 5.7135 |
| logSw: | -5.6941 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.95 |
| InChI Key: | OPCDJWYQWHOYIQ-UHFFFAOYSA-N |