2-[4-(4-chlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-phenoxyethyl)-3-phenylpropanamide
Chemical Structure Depiction of
2-[4-(4-chlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-phenoxyethyl)-3-phenylpropanamide
2-[4-(4-chlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-phenoxyethyl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | V001-6573 |
| Compound Name: | 2-[4-(4-chlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-phenoxyethyl)-3-phenylpropanamide |
| Molecular Weight: | 559.07 |
| Molecular Formula: | C31 H31 Cl N4 O4 |
| Smiles: | CCN1C2CN(C(Cc3ccccc3)C(NCCOc3ccccc3)=O)C(C=2C(c2ccc(cc2)[Cl])NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0971 |
| logD: | 5.0566 |
| logSw: | -5.5936 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.225 |
| InChI Key: | MMWPOHXHYRSAFO-UHFFFAOYSA-N |