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]-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
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]-N-(2-phenylethyl)acetamide
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]-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | V003-9936 |
| Compound Name: | 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]-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 460.58 |
| Molecular Formula: | C27 H32 N4 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)C1C2=C(CN(CC(NCCc3ccccc3)=O)C2=O)N(C)C(N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0274 |
| logD: | 2.9845 |
| logSw: | -3.3304 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.815 |
| InChI Key: | GMJFVGJGCFXIQM-XMMPIXPASA-N |