N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)acetamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)acetamide
N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)acetamide
Compound characteristics
Compound ID: | S466-0126 |
Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)acetamide |
Molecular Weight: | 396.44 |
Molecular Formula: | C21 H24 N4 O4 |
Smiles: | Cc1cc2c(C(N3CCCC3=N2)=O)n1CC(NCc1ccc(c(c1)OC)OC)=O |
Stereo: | ACHIRAL |
logP: | 0.9463 |
logD: | 0.9463 |
logSw: | -2.1654 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.049 |
InChI Key: | PRTHVKPOXSMWOR-UHFFFAOYSA-N |