1-benzyl-7-[(3-chlorophenyl)methyl]-3-(4-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-7-[(3-chlorophenyl)methyl]-3-(4-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-7-[(3-chlorophenyl)methyl]-3-(4-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V022-9055 |
| Compound Name: | 1-benzyl-7-[(3-chlorophenyl)methyl]-3-(4-methylphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 456.93 |
| Molecular Formula: | C26 H21 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)N1C(N(Cc2ccccc2)C(c2c1ncn2Cc1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0316 |
| logD: | 5.0316 |
| logSw: | -5.0206 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.275 |
| InChI Key: | VEYYVHOWLCLLAX-UHFFFAOYSA-N |