8-(2-benzoyl-5-methoxyphenoxy)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(2-benzoyl-5-methoxyphenoxy)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
8-(2-benzoyl-5-methoxyphenoxy)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8017-1807 |
| Compound Name: | 8-(2-benzoyl-5-methoxyphenoxy)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 420.42 |
| Molecular Formula: | C22 H20 N4 O5 |
| Smiles: | CN1C(c2c(nc(n2C)Oc2cc(ccc2C(c2ccccc2)=O)OC)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2394 |
| logD: | 3.2394 |
| logSw: | -3.8795 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.932 |
| InChI Key: | FCQMYUVQLXZZDP-UHFFFAOYSA-N |