3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-2-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-1(2H)-one
Chemical Structure Depiction of
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-2-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-1(2H)-one
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-2-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-1(2H)-one
Compound characteristics
| Compound ID: | S531-0182 |
| Compound Name: | 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-2-methyl-3,4-dihydropyrrolo[1,2-a]pyrazin-1(2H)-one |
| Molecular Weight: | 396.44 |
| Molecular Formula: | C21 H24 N4 O4 |
| Smiles: | CN1C(Cn2cccc2C1=O)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9615 |
| logD: | 0.6852 |
| logSw: | -1.8402 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.874 |
| InChI Key: | XVIAXQSIKPSMRZ-KRWDZBQOSA-N |