N-benzyl-2-[4-(2-chlorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[4-(2-chlorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide
N-benzyl-2-[4-(2-chlorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide
Compound characteristics
| Compound ID: | V019-5366 |
| Compound Name: | N-benzyl-2-[4-(2-chlorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide |
| Molecular Weight: | 450.92 |
| Molecular Formula: | C24 H23 Cl N4 O3 |
| Smiles: | C=CCN1C2CN(CC(NCc3ccccc3)=O)C(C=2C(c2ccccc2[Cl])NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8966 |
| logD: | 2.8775 |
| logSw: | -3.4044 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.186 |
| InChI Key: | WLEBWAYOODKVGC-JOCHJYFZSA-N |