N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-oxo-2-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-oxo-2-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-oxo-2-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide
Compound characteristics
| Compound ID: | S531-0767 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-oxo-2-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine-3-carboxamide |
| Molecular Weight: | 404.42 |
| Molecular Formula: | C22 H20 N4 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(C1Cn2cccc2C(N1Cc1cccnc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2977 |
| logD: | 1.2977 |
| logSw: | -1.4924 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.579 |
| InChI Key: | GCMRHRRVZLDTOP-SFHVURJKSA-N |