2-(2-chloro-6-fluorophenyl)-9-(3-methoxyphenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
2-(2-chloro-6-fluorophenyl)-9-(3-methoxyphenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
2-(2-chloro-6-fluorophenyl)-9-(3-methoxyphenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | C429-1034 |
| Compound Name: | 2-(2-chloro-6-fluorophenyl)-9-(3-methoxyphenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 427.82 |
| Molecular Formula: | C20 H15 Cl F N5 O3 |
| Smiles: | CN1C(N(c2cccc(c2)OC)c2c1c(C(N)=O)nc(c1c(cccc1[Cl])F)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2934 |
| logD: | 3.2934 |
| logSw: | -4.0493 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.387 |
| InChI Key: | YPNYFUSITWICMU-UHFFFAOYSA-N |