ethyl 4-[5-(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)-2-methylbenzene-1-sulfonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[5-(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)-2-methylbenzene-1-sulfonyl]piperazine-1-carboxylate
ethyl 4-[5-(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)-2-methylbenzene-1-sulfonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | D505-0260 |
| Compound Name: | ethyl 4-[5-(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrophthalazin-1-yl)-2-methylbenzene-1-sulfonyl]piperazine-1-carboxylate |
| Molecular Weight: | 488.61 |
| Molecular Formula: | C24 H32 N4 O5 S |
| Smiles: | CCN1C(C2CCCCC=2C(c2ccc(C)c(c2)S(N2CCN(CC2)C(=O)OCC)(=O)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8955 |
| logD: | 3.8955 |
| logSw: | -3.8227 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.875 |
| InChI Key: | LZUMGDGGOQVYAF-UHFFFAOYSA-N |