N-benzyl-3-[4-(2,3-dichlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(dimethylamino)ethyl]propanamide
Chemical Structure Depiction of
N-benzyl-3-[4-(2,3-dichlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(dimethylamino)ethyl]propanamide
N-benzyl-3-[4-(2,3-dichlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(dimethylamino)ethyl]propanamide
Compound characteristics
| Compound ID: | V011-1209 |
| Compound Name: | N-benzyl-3-[4-(2,3-dichlorophenyl)-1-methyl-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(dimethylamino)ethyl]propanamide |
| Molecular Weight: | 544.48 |
| Molecular Formula: | C27 H31 Cl2 N5 O3 |
| Salt: | not_available |
| Smiles: | CN(C)CCN(Cc1ccccc1)C(CCN1CC2=C(C(c3cccc(c3[Cl])[Cl])NC(N2C)=O)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8586 |
| logD: | 1.9697 |
| logSw: | -3.7259 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.28 |
| InChI Key: | FIVGXTXRPUMMLW-RUZDIDTESA-N |