N-[(3,4-diethoxyphenyl)methyl]-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-[(3,4-diethoxyphenyl)methyl]-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
N-[(3,4-diethoxyphenyl)methyl]-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | D315-1973 |
| Compound Name: | N-[(3,4-diethoxyphenyl)methyl]-2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonamide |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C26 H31 N3 O5 S |
| Smiles: | CCOc1ccc(CNS(c2cc(ccc2C)C2C3CCCCC=3C(NN=2)=O)(=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.7734 |
| logD: | 4.7723 |
| logSw: | -4.4216 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.729 |
| InChI Key: | JVHQNYWMUOPGAJ-UHFFFAOYSA-N |