2-[1-ethyl-4-(3-nitrophenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(4-fluorophenyl)propanamide
Chemical Structure Depiction of
2-[1-ethyl-4-(3-nitrophenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(4-fluorophenyl)propanamide
2-[1-ethyl-4-(3-nitrophenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(4-fluorophenyl)propanamide
Compound characteristics
| Compound ID: | V026-5762 |
| Compound Name: | 2-[1-ethyl-4-(3-nitrophenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(4-fluorophenyl)propanamide |
| Molecular Weight: | 467.46 |
| Molecular Formula: | C23 H22 F N5 O5 |
| Salt: | not_available |
| Smiles: | CCN1C2CN(C(C)C(Nc3ccc(cc3)F)=O)C(C=2C(c2cccc(c2)[N+]([O-])=O)NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4833 |
| logD: | 2.2635 |
| logSw: | -3.0329 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.712 |
| InChI Key: | LIPRJIKOKJLQSV-UHFFFAOYSA-N |