N-(1-benzylpiperidin-4-yl)-2-[4-(2,4-dichlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-2-[4-(2,4-dichlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanamide
N-(1-benzylpiperidin-4-yl)-2-[4-(2,4-dichlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanamide
Compound characteristics
| Compound ID: | V004-3321 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-2-[4-(2,4-dichlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanamide |
| Molecular Weight: | 570.52 |
| Molecular Formula: | C29 H33 Cl2 N5 O3 |
| Salt: | not_available |
| Smiles: | CCN1C2CN(C(C)C(NC3CCN(CC3)Cc3ccccc3)=O)C(C=2C(c2ccc(cc2[Cl])[Cl])NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.068 |
| logD: | 2.5103 |
| logSw: | -4.2734 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.919 |
| InChI Key: | VCKKPIZFNAWEJF-UHFFFAOYSA-N |