1-benzyl-7-[2-(4-methoxyphenyl)-2-oxoethyl]-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-7-[2-(4-methoxyphenyl)-2-oxoethyl]-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-7-[2-(4-methoxyphenyl)-2-oxoethyl]-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0541 |
| Compound Name: | 1-benzyl-7-[2-(4-methoxyphenyl)-2-oxoethyl]-3-(2-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 480.52 |
| Molecular Formula: | C28 H24 N4 O4 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1N1C(N(Cc2ccccc2)C(c2c1ncn2CC(c1ccc(cc1)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8629 |
| logD: | 3.8629 |
| logSw: | -4.1566 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.764 |
| InChI Key: | FDAVAIVGIDGLBO-UHFFFAOYSA-N |