2-[1-ethyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-methyl-3-phenyl-N-(propan-2-yl)propanamide
Chemical Structure Depiction of
2-[1-ethyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-methyl-3-phenyl-N-(propan-2-yl)propanamide
2-[1-ethyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-methyl-3-phenyl-N-(propan-2-yl)propanamide
Compound characteristics
| Compound ID: | V004-2897 |
| Compound Name: | 2-[1-ethyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-methyl-3-phenyl-N-(propan-2-yl)propanamide |
| Molecular Weight: | 552.67 |
| Molecular Formula: | C33 H36 N4 O4 |
| Smiles: | CCN1C2CN(C(Cc3ccccc3)C(N(C)C(C)C)=O)C(C=2C(c2cccc(c2)Oc2ccccc2)NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0961 |
| logD: | 5.091 |
| logSw: | -4.9169 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.273 |
| InChI Key: | QQKBDPJVLRPQCH-UHFFFAOYSA-N |