2-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N,N-dipropylacetamide
Chemical Structure Depiction of
2-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N,N-dipropylacetamide
2-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N,N-dipropylacetamide
Compound characteristics
| Compound ID: | V018-7334 |
| Compound Name: | 2-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N,N-dipropylacetamide |
| Molecular Weight: | 418.92 |
| Molecular Formula: | C21 H27 Cl N4 O3 |
| Smiles: | CCCN(CCC)C(CN1CC2=C(C(c3ccccc3[Cl])NC(N2C)=O)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2844 |
| logD: | 2.2415 |
| logSw: | -3.1616 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.686 |
| InChI Key: | BNEBHCNMKJTFIW-LJQANCHMSA-N |