9-(4-fluorophenyl)-7-methyl-8-oxo-2-(2,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(4-fluorophenyl)-7-methyl-8-oxo-2-(2,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
9-(4-fluorophenyl)-7-methyl-8-oxo-2-(2,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
Compound ID: | G656-0943 |
Compound Name: | 9-(4-fluorophenyl)-7-methyl-8-oxo-2-(2,4,5-trimethoxyphenyl)-8,9-dihydro-7H-purine-6-carboxamide |
Molecular Weight: | 453.43 |
Molecular Formula: | C22 H20 F N5 O5 |
Smiles: | CN1C(N(c2ccc(cc2)F)c2c1c(C(N)=O)nc(c1cc(c(cc1OC)OC)OC)n2)=O |
Stereo: | ACHIRAL |
logP: | 2.3497 |
logD: | 2.3497 |
logSw: | -2.9116 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 95.735 |
InChI Key: | JDPYEWUCESKKTE-UHFFFAOYSA-N |