4-[4-ethyl-3-(4-methylpiperazine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Chemical Structure Depiction of
4-[4-ethyl-3-(4-methylpiperazine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
4-[4-ethyl-3-(4-methylpiperazine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one
Compound characteristics
| Compound ID: | F153-1394 |
| Compound Name: | 4-[4-ethyl-3-(4-methylpiperazine-1-sulfonyl)phenyl]-5,6,7,8-tetrahydrophthalazin-1(2H)-one |
| Molecular Weight: | 416.54 |
| Molecular Formula: | C21 H28 N4 O3 S |
| Smiles: | CCc1ccc(cc1S(N1CCN(C)CC1)(=O)=O)C1C2CCCCC=2C(NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3958 |
| logD: | 3.3323 |
| logSw: | -3.7933 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.738 |
| InChI Key: | DNVZPHZQGKQXPO-UHFFFAOYSA-N |