5-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}pyrrolidin-1-yl)-2-methylpyridazin-3(2H)-one
Chemical Structure Depiction of
5-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}pyrrolidin-1-yl)-2-methylpyridazin-3(2H)-one
5-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}pyrrolidin-1-yl)-2-methylpyridazin-3(2H)-one
Compound characteristics
| Compound ID: | S576-0181 |
| Compound Name: | 5-(3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}pyrrolidin-1-yl)-2-methylpyridazin-3(2H)-one |
| Molecular Weight: | 425.49 |
| Molecular Formula: | C22 H27 N5 O4 |
| Smiles: | CN1C(C=C(C=N1)N1CCC(C1)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.818 |
| logD: | 0.3497 |
| logSw: | -1.7148 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.048 |
| InChI Key: | DFOCTULERQUUHN-QGZVFWFLSA-N |