N-benzyl-2-[4-(2,4-dichlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
N-benzyl-2-[4-(2,4-dichlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-phenylethyl)acetamide
N-benzyl-2-[4-(2,4-dichlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-phenylethyl)acetamide
Compound characteristics
Compound ID: | V004-7228 |
Compound Name: | N-benzyl-2-[4-(2,4-dichlorophenyl)-1-ethyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-phenylethyl)acetamide |
Molecular Weight: | 577.51 |
Molecular Formula: | C31 H30 Cl2 N4 O3 |
Smiles: | CCN1C2CN(CC(N(CCc3ccccc3)Cc3ccccc3)=O)C(C=2C(c2ccc(cc2[Cl])[Cl])NC1=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.2434 |
logD: | 5.2029 |
logSw: | -5.7151 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.123 |
InChI Key: | AFVMNNCQVNMXCA-GDLZYMKVSA-N |