ethyl 4-({7-[(3,4-diethoxyphenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}oxy)benzoate
Chemical Structure Depiction of
ethyl 4-({7-[(3,4-diethoxyphenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}oxy)benzoate
ethyl 4-({7-[(3,4-diethoxyphenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}oxy)benzoate
Compound characteristics
| Compound ID: | 8015-6817 |
| Compound Name: | ethyl 4-({7-[(3,4-diethoxyphenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}oxy)benzoate |
| Molecular Weight: | 522.56 |
| Molecular Formula: | C27 H30 N4 O7 |
| Smiles: | CCOC(c1ccc(cc1)Oc1nc2c(C(N(C)C(N2C)=O)=O)n1Cc1ccc(c(c1)OCC)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7004 |
| logD: | 4.7004 |
| logSw: | -4.5064 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.927 |
| InChI Key: | HWCJIOFNIKSIDI-UHFFFAOYSA-N |