N-[2-(4-chlorophenyl)ethyl]-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-[2-(4-chlorophenyl)ethyl]-2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)acetamide
N-[2-(4-chlorophenyl)ethyl]-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: | S466-0093 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-(2-methyl-9-oxo-5,6,7,9-tetrahydro-1H-dipyrrolo[1,2-a:3',2'-d]pyrimidin-1-yl)acetamide |
| Molecular Weight: | 384.86 |
| Molecular Formula: | C20 H21 Cl N4 O2 |
| Smiles: | Cc1cc2c(C(N3CCCC3=N2)=O)n1CC(NCCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7008 |
| logD: | 1.7008 |
| logSw: | -2.852 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.63 |
| InChI Key: | SKSPZTTYADFBHD-UHFFFAOYSA-N |