ethyl [6-carbamoyl-9-(4-fluorophenyl)-2-(3-methoxyphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
Chemical Structure Depiction of
ethyl [6-carbamoyl-9-(4-fluorophenyl)-2-(3-methoxyphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
ethyl [6-carbamoyl-9-(4-fluorophenyl)-2-(3-methoxyphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
Compound characteristics
| Compound ID: | G656-1023 |
| Compound Name: | ethyl [6-carbamoyl-9-(4-fluorophenyl)-2-(3-methoxyphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate |
| Molecular Weight: | 465.44 |
| Molecular Formula: | C23 H20 F N5 O5 |
| Smiles: | CCOC(CN1C(N(c2ccc(cc2)F)c2c1c(C(N)=O)nc(c1cccc(c1)OC)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6793 |
| logD: | 3.6793 |
| logSw: | -4.1541 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.78 |
| InChI Key: | KHGFSUVRUPCTSS-UHFFFAOYSA-N |