N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | 7599-1414 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetamide |
| Molecular Weight: | 493.52 |
| Molecular Formula: | C25 H27 N5 O6 |
| Smiles: | CN1C(c2c(nc(c3ccc(cc3)OCC(NCCc3ccc(c(c3)OC)OC)=O)[nH]2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1612 |
| logD: | 2.0118 |
| logSw: | -2.9237 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.605 |
| InChI Key: | CVZBOABFLIZEJV-UHFFFAOYSA-N |