ethyl 4-[2-methyl-5-(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-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperazine-1-carboxylate
ethyl 4-[2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | D315-1870 |
| Compound Name: | ethyl 4-[2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperazine-1-carboxylate |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C22 H28 N4 O5 S |
| Smiles: | CCOC(N1CCN(CC1)S(c1cc(ccc1C)C1C2CCCCC=2C(NN=1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7128 |
| logD: | 3.712 |
| logSw: | -3.8777 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.041 |
| InChI Key: | GQZJEIIAUZTBQD-UHFFFAOYSA-N |