ethyl 1-[2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperidine-4-carboxylate
ethyl 1-[2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | D315-1869 |
| Compound Name: | ethyl 1-[2-methyl-5-(4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)benzene-1-sulfonyl]piperidine-4-carboxylate |
| Molecular Weight: | 459.56 |
| Molecular Formula: | C23 H29 N3 O5 S |
| Smiles: | CCOC(C1CCN(CC1)S(c1cc(ccc1C)C1C2CCCCC=2C(NN=1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.145 |
| logD: | 4.1442 |
| logSw: | -4.0587 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.015 |
| InChI Key: | POALSXQCCIQJBR-UHFFFAOYSA-N |