N-[(furan-2-yl)methyl]-2-[1-methyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-2-phenylacetamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-2-[1-methyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-2-phenylacetamide
N-[(furan-2-yl)methyl]-2-[1-methyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-2-phenylacetamide
Compound characteristics
| Compound ID: | V004-5096 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-[1-methyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-2-phenylacetamide |
| Molecular Weight: | 548.6 |
| Molecular Formula: | C32 H28 N4 O5 |
| Smiles: | CN1C2CN(C(C(NCc3ccco3)=O)c3ccccc3)C(C=2C(c2cccc(c2)Oc2ccccc2)NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4456 |
| logD: | 4.4317 |
| logSw: | -4.4148 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.539 |
| InChI Key: | ZADVPFISWHQJOC-UHFFFAOYSA-N |