N-(3-cyanophenyl)-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-cyanophenyl)-2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)acetamide
N-(3-cyanophenyl)-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: | S466-0125 |
| Compound Name: | N-(3-cyanophenyl)-2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)acetamide |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C19 H17 N5 O2 |
| Smiles: | Cc1cc2c(C(N3CCCC3=N2)=O)n1CC(Nc1cccc(C#N)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6146 |
| logD: | 1.6143 |
| logSw: | -2.2806 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.523 |
| InChI Key: | GSYMTDJLMGXUJU-UHFFFAOYSA-N |