N-(1-benzylpiperidin-4-yl)-2-[4-(4-tert-butylphenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-2-[4-(4-tert-butylphenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide
N-(1-benzylpiperidin-4-yl)-2-[4-(4-tert-butylphenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide
Compound characteristics
| Compound ID: | V003-9948 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-2-[4-(4-tert-butylphenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide |
| Molecular Weight: | 529.68 |
| Molecular Formula: | C31 H39 N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(cc1)C1C2=C(CN(CC(NC3CCN(CC3)Cc3ccccc3)=O)C2=O)N(C)C(N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3779 |
| logD: | 1.8201 |
| logSw: | -3.4654 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.24 |
| InChI Key: | OKGDRAGVAKSPRM-NDEPHWFRSA-N |