4-(2-chlorophenyl)-6-{2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxoethyl}-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
4-(2-chlorophenyl)-6-{2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxoethyl}-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
4-(2-chlorophenyl)-6-{2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxoethyl}-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | V008-2070 |
| Compound Name: | 4-(2-chlorophenyl)-6-{2-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-oxoethyl}-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 524.02 |
| Molecular Formula: | C27 H30 Cl N5 O4 |
| Salt: | not_available |
| Smiles: | CCOc1ccccc1N1CCN(CC1)C(CN1CC2=C(C(c3ccccc3[Cl])NC(N2C)=O)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6049 |
| logD: | 2.5614 |
| logSw: | -3.3489 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.064 |
| InChI Key: | LIVPQKWIZWFHGJ-RUZDIDTESA-N |