2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-cyclooctyl-3-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-1-carboxamide
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-cyclooctyl-3-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-1-carboxamide
2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-cyclooctyl-3-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-1-carboxamide
Compound characteristics
| Compound ID: | C537-0400 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-cyclooctyl-3-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-1-carboxamide |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C24 H29 N3 O4 |
| Smiles: | C1CCCC(CCC1)NC(C1c2cccn2CC(N1Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8565 |
| logD: | 3.8565 |
| logSw: | -3.9338 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.219 |
| InChI Key: | CJOUVWIDQJCIRV-HSZRJFAPSA-N |