3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-(4-chlorobenzene-1-sulfonyl)pyridazine
Chemical Structure Depiction of
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-(4-chlorobenzene-1-sulfonyl)pyridazine
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-(4-chlorobenzene-1-sulfonyl)pyridazine
Compound characteristics
| Compound ID: | F807-0481 |
| Compound Name: | 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6-(4-chlorobenzene-1-sulfonyl)pyridazine |
| Molecular Weight: | 472.95 |
| Molecular Formula: | C22 H21 Cl N4 O4 S |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)c1ccc(nn1)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7096 |
| logD: | 2.9824 |
| logSw: | -4.2242 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.829 |
| InChI Key: | NTNBAOKGEUIBAC-UHFFFAOYSA-N |