1-benzyl-7-[(3-methylphenyl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-7-[(3-methylphenyl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-7-[(3-methylphenyl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V021-3014 |
| Compound Name: | 1-benzyl-7-[(3-methylphenyl)methyl]-3-phenyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 422.49 |
| Molecular Formula: | C26 H22 N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(Cn2cnc3c2C(N(Cc2ccccc2)C(N3c2ccccc2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.4778 |
| logD: | 4.4778 |
| logSw: | -4.4354 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.275 |
| InChI Key: | VKUPNOQWGXVNBK-UHFFFAOYSA-N |