3-[1-ethyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(pyridin-2-yl)ethyl]propanamide
Chemical Structure Depiction of
3-[1-ethyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(pyridin-2-yl)ethyl]propanamide
3-[1-ethyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(pyridin-2-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | V004-2271 |
| Compound Name: | 3-[1-ethyl-2,5-dioxo-4-(3-phenoxyphenyl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(pyridin-2-yl)ethyl]propanamide |
| Molecular Weight: | 525.61 |
| Molecular Formula: | C30 H31 N5 O4 |
| Salt: | not_available |
| Smiles: | CCN1C2CN(CCC(NCCc3ccccn3)=O)C(C=2C(c2cccc(c2)Oc2ccccc2)NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6635 |
| logD: | 2.6536 |
| logSw: | -3.0727 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.044 |
| InChI Key: | ZQUDBVCGSZDODQ-NDEPHWFRSA-N |