7-[(4-methoxyphenyl)methyl]-3-(2-methylphenyl)-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-methoxyphenyl)methyl]-3-(2-methylphenyl)-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
7-[(4-methoxyphenyl)methyl]-3-(2-methylphenyl)-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1707 |
| Compound Name: | 7-[(4-methoxyphenyl)methyl]-3-(2-methylphenyl)-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C23 H22 N4 O3 |
| Smiles: | Cc1ccccc1N1C(N(CC=C)C(c2c1ncn2Cc1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2453 |
| logD: | 3.2453 |
| logSw: | -3.3961 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.767 |
| InChI Key: | BQAUUWAQJBIJCY-UHFFFAOYSA-N |