1,7-dibenzyl-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,7-dibenzyl-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
1,7-dibenzyl-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V025-0208 |
| Compound Name: | 1,7-dibenzyl-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 438.49 |
| Molecular Formula: | C26 H22 N4 O3 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)N1C(N(Cc2ccccc2)C(c2c1ncn2Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1167 |
| logD: | 4.1167 |
| logSw: | -4.4182 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.818 |
| InChI Key: | GAFIFPZLGHFVGX-UHFFFAOYSA-N |