3-(2-chlorophenyl)-7-[(3-chlorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2-chlorophenyl)-7-[(3-chlorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
3-(2-chlorophenyl)-7-[(3-chlorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V018-2064 |
| Compound Name: | 3-(2-chlorophenyl)-7-[(3-chlorophenyl)methyl]-1-(2-methoxyethyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 445.3 |
| Molecular Formula: | C21 H18 Cl2 N4 O3 |
| Smiles: | COCCN1C(c2c(ncn2Cc2cccc(c2)[Cl])N(C1=O)c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3706 |
| logD: | 3.3706 |
| logSw: | -3.4311 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.566 |
| InChI Key: | CNNMIXCYCNGMOB-UHFFFAOYSA-N |