3-(4-chlorophenyl)-7-[(2-methylphenyl)methyl]-1-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-[(2-methylphenyl)methyl]-1-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
3-(4-chlorophenyl)-7-[(2-methylphenyl)methyl]-1-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-6435 |
| Compound Name: | 3-(4-chlorophenyl)-7-[(2-methylphenyl)methyl]-1-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 470.96 |
| Molecular Formula: | C27 H23 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1Cn1cnc2c1C(N(CCc1ccccc1)C(N2c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4848 |
| logD: | 5.4848 |
| logSw: | -5.7961 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.253 |
| InChI Key: | TZKOJVHJLDUNAF-UHFFFAOYSA-N |