4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1-butylpyrrolidin-2-one
Chemical Structure Depiction of
4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1-butylpyrrolidin-2-one
4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1-butylpyrrolidin-2-one
Compound characteristics
| Compound ID: | Y031-4957 |
| Compound Name: | 4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1-butylpyrrolidin-2-one |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C21 H29 N3 O4 |
| Smiles: | CCCCN1CC(CC1=O)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5369 |
| logD: | 1.0686 |
| logSw: | -2.0227 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.988 |
| InChI Key: | VRHDIVFRIJLJEH-QGZVFWFLSA-N |