2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | S466-0002 |
| Compound Name: | 2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 390.36 |
| Molecular Formula: | C19 H17 F3 N4 O2 |
| Smiles: | Cc1cc2c(C(N3CCCC3=N2)=O)n1CC(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7969 |
| logD: | 2.7956 |
| logSw: | -3.315 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.466 |
| InChI Key: | LQCJVRGHQLHWIR-UHFFFAOYSA-N |