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-(2-methoxyethyl)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-(2-methoxyethyl)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-(2-methoxyethyl)propanamide
Compound characteristics
| Compound ID: | V003-9110 |
| 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-(2-methoxyethyl)propanamide |
| Molecular Weight: | 431.45 |
| Molecular Formula: | C20 H25 N5 O6 |
| Smiles: | CCN1C2CN(C(C)C(NCCOC)=O)C(C=2C(c2cccc(c2)[N+]([O-])=O)NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.7161 |
| logD: | 0.4963 |
| logSw: | -2.1989 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.49 |
| InChI Key: | AUKFDOGYYAOREE-UHFFFAOYSA-N |