ethyl [6-carbamoyl-9-(4-fluorophenyl)-8-oxo-2-(pyridin-3-yl)-8,9-dihydro-7H-purin-7-yl]acetate
Chemical Structure Depiction of
ethyl [6-carbamoyl-9-(4-fluorophenyl)-8-oxo-2-(pyridin-3-yl)-8,9-dihydro-7H-purin-7-yl]acetate
ethyl [6-carbamoyl-9-(4-fluorophenyl)-8-oxo-2-(pyridin-3-yl)-8,9-dihydro-7H-purin-7-yl]acetate
Compound characteristics
| Compound ID: | G656-1043 |
| Compound Name: | ethyl [6-carbamoyl-9-(4-fluorophenyl)-8-oxo-2-(pyridin-3-yl)-8,9-dihydro-7H-purin-7-yl]acetate |
| Molecular Weight: | 436.4 |
| Molecular Formula: | C21 H17 F N6 O4 |
| Smiles: | CCOC(CN1C(N(c2ccc(cc2)F)c2c1c(C(N)=O)nc(c1cccnc1)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1383 |
| logD: | 1.1882 |
| logSw: | -2.0215 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.755 |
| InChI Key: | UFSOXCDPXPEGNU-UHFFFAOYSA-N |