4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1,5-bis(4-methoxyphenyl)pyrrolidin-2-one
Chemical Structure Depiction of
4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1,5-bis(4-methoxyphenyl)pyrrolidin-2-one
4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1,5-bis(4-methoxyphenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | C141-0100 |
| Compound Name: | 4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-1,5-bis(4-methoxyphenyl)pyrrolidin-2-one |
| Molecular Weight: | 543.62 |
| Molecular Formula: | C31 H33 N3 O6 |
| Smiles: | COc1ccc(cc1)C1C(CC(N1c1ccc(cc1)OC)=O)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4553 |
| logD: | 2.987 |
| logSw: | -3.5557 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.347 |
| InChI Key: | JRNOASBGIVATNU-UHFFFAOYSA-N |