1-benzyl-7-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-7-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-7-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V021-6071 |
| Compound Name: | 1-benzyl-7-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-(3-methoxyphenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 494.55 |
| Molecular Formula: | C29 H26 N4 O4 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C(Cn2cnc3c2C(N(Cc2ccccc2)C(N3c2cccc(c2)OC)=O)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6744 |
| logD: | 4.6744 |
| logSw: | -4.55 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.065 |
| InChI Key: | HHQQHPWDCBXWRG-UHFFFAOYSA-N |