3-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-7-phenyl-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
Chemical Structure Depiction of
3-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-7-phenyl-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
3-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-7-phenyl-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | F986-0042 |
| Compound Name: | 3-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-7-phenyl-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C26 H27 N5 O3 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(CN1C(c2c(c(c[nH]2)c2ccccc2)NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6171 |
| logD: | 3.617 |
| logSw: | -3.8116 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.326 |
| InChI Key: | APDDTHKJGFPQKH-UHFFFAOYSA-N |