4-[4-ethyl-3-(4-ethylpiperazine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Chemical Structure Depiction of
4-[4-ethyl-3-(4-ethylpiperazine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
4-[4-ethyl-3-(4-ethylpiperazine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Compound characteristics
| Compound ID: | F153-1416 |
| Compound Name: | 4-[4-ethyl-3-(4-ethylpiperazine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one |
| Molecular Weight: | 430.57 |
| Molecular Formula: | C22 H30 N4 O3 S |
| Smiles: | CCc1ccc(cc1S(N1CCN(CC)CC1)(=O)=O)C1C2CCCCC=2C(NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7405 |
| logD: | 3.653 |
| logSw: | -3.8073 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.798 |
| InChI Key: | HIBKZYCSYQZJQW-UHFFFAOYSA-N |