ethyl 4-[2-methyl-5-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-methyl-5-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperazine-1-carboxylate
ethyl 4-[2-methyl-5-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | D505-0081 |
| Compound Name: | ethyl 4-[2-methyl-5-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperazine-1-carboxylate |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C23 H30 N4 O5 S |
| Smiles: | CCOC(N1CCN(CC1)S(c1cc(ccc1C)C1C2CCCCC=2C(N(C)N=1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4883 |
| logD: | 3.4883 |
| logSw: | -3.719 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.829 |
| InChI Key: | HMZUJNFSIXFANS-UHFFFAOYSA-N |