2-[1-ethyl-4-(3-methylphenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]-3-phenylpropanamide
Chemical Structure Depiction of
2-[1-ethyl-4-(3-methylphenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]-3-phenylpropanamide
2-[1-ethyl-4-(3-methylphenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]-3-phenylpropanamide
Compound characteristics
| Compound ID: | V014-2864 |
| Compound Name: | 2-[1-ethyl-4-(3-methylphenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]-3-phenylpropanamide |
| Molecular Weight: | 502.61 |
| Molecular Formula: | C29 H34 N4 O4 |
| Smiles: | CCN1C2CN(C(Cc3ccccc3)C(NCC3CCCO3)=O)C(C=2C(c2cccc(C)c2)NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4111 |
| logD: | 3.3953 |
| logSw: | -3.6037 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.62 |
| InChI Key: | AGJAHZGDLZAKDM-UHFFFAOYSA-N |