8-{[(3,4-dimethoxyphenyl)methyl]amino}-1,3-diethyl-7-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{[(3,4-dimethoxyphenyl)methyl]amino}-1,3-diethyl-7-methyl-3,7-dihydro-1H-purine-2,6-dione
8-{[(3,4-dimethoxyphenyl)methyl]amino}-1,3-diethyl-7-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | H025-3137 |
Compound Name: | 8-{[(3,4-dimethoxyphenyl)methyl]amino}-1,3-diethyl-7-methyl-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 387.44 |
Molecular Formula: | C19 H25 N5 O4 |
Smiles: | CCN1C(c2c(nc(NCc3ccc(c(c3)OC)OC)n2C)N(CC)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0123 |
logD: | 2.0117 |
logSw: | -2.6524 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.107 |
InChI Key: | QVIDBCJIFCFZAZ-UHFFFAOYSA-N |