7-[(2,6-dichlorophenyl)methyl]-8-(2-methoxyphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2,6-dichlorophenyl)methyl]-8-(2-methoxyphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-[(2,6-dichlorophenyl)methyl]-8-(2-methoxyphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5339-0545 |
| Compound Name: | 7-[(2,6-dichlorophenyl)methyl]-8-(2-methoxyphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 461.3 |
| Molecular Formula: | C21 H18 Cl2 N4 O4 |
| Smiles: | CN1C(c2c(nc(n2Cc2c(cccc2[Cl])[Cl])Oc2ccccc2OC)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0986 |
| logD: | 5.0986 |
| logSw: | -5.4426 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.47 |
| InChI Key: | SJOJBJSCYWGPMX-UHFFFAOYSA-N |