3-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-7-(2-fluorophenyl)-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-(2-fluorophenyl)-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
3-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-7-(2-fluorophenyl)-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | F986-0571 |
| Compound Name: | 3-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-7-(2-fluorophenyl)-1H-pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione |
| Molecular Weight: | 475.52 |
| Molecular Formula: | C26 H26 F N5 O3 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(CN1C(c2c(c(c[nH]2)c2ccccc2F)NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5188 |
| logD: | 3.5184 |
| logSw: | -3.8001 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.326 |
| InChI Key: | XQYMFUWNDFZUFS-UHFFFAOYSA-N |