ethyl N-{5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonyl}glycinate
Chemical Structure Depiction of
ethyl N-{5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonyl}glycinate
ethyl N-{5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonyl}glycinate
Compound characteristics
| Compound ID: | 4109-2036 |
| Compound Name: | ethyl N-{5-[4-(3,4-dichloroanilino)phthalazin-1-yl]-2-methylbenzene-1-sulfonyl}glycinate |
| Molecular Weight: | 545.44 |
| Molecular Formula: | C25 H22 Cl2 N4 O4 S |
| Smiles: | CCOC(CNS(c1cc(ccc1C)c1c2ccccc2c(Nc2ccc(c(c2)[Cl])[Cl])nn1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1479 |
| logD: | 6.1458 |
| logSw: | -6.1707 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.95 |
| InChI Key: | YEGJMXMFNAMRAR-UHFFFAOYSA-N |