9-(4-fluorophenyl)-8-oxo-2-(2,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(4-fluorophenyl)-8-oxo-2-(2,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
9-(4-fluorophenyl)-8-oxo-2-(2,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | G656-0799 |
| Compound Name: | 9-(4-fluorophenyl)-8-oxo-2-(2,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 439.4 |
| Molecular Formula: | C21 H18 F N5 O5 |
| Smiles: | [H]N1C(N(c2ccc(cc2)F)c2c1c(C(N)=O)nc(c1cc(c(cc1OC)OC)OC)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9782 |
| logD: | 1.9406 |
| logSw: | -2.8676 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.502 |
| InChI Key: | VOIJIIXWRPUSAZ-UHFFFAOYSA-N |