ethyl 1-{3-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanoyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanoyl}piperidine-4-carboxylate
ethyl 1-{3-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanoyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V015-8157 |
| Compound Name: | ethyl 1-{3-[4-(2-chlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanoyl}piperidine-4-carboxylate |
| Molecular Weight: | 488.97 |
| Molecular Formula: | C24 H29 Cl N4 O5 |
| Smiles: | CCOC(C1CCN(CC1)C(CCN1CC2=C(C(c3ccccc3[Cl])NC(N2C)=O)C1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5133 |
| logD: | 1.4704 |
| logSw: | -2.5848 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.627 |
| InChI Key: | NUOQQBXADZKPPQ-OAQYLSRUSA-N |