6-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-4-(2-chlorophenyl)-1-(prop-2-en-1-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
6-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-4-(2-chlorophenyl)-1-(prop-2-en-1-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
6-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-4-(2-chlorophenyl)-1-(prop-2-en-1-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | V026-4199 |
| Compound Name: | 6-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-4-(2-chlorophenyl)-1-(prop-2-en-1-yl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 471.94 |
| Molecular Formula: | C23 H26 Cl N5 O4 |
| Smiles: | CC(N1CCN(CC1)C(CN1CC2=C(C(c3ccccc3[Cl])NC(N2CC=C)=O)C1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9103 |
| logD: | 0.8913 |
| logSw: | -2.3961 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.303 |
| InChI Key: | XCMYUKFQBIUTFV-OAQYLSRUSA-N |