ethyl [6-carbamoyl-2-(3,5-dimethoxyphenyl)-9-(3-methoxyphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
Chemical Structure Depiction of
ethyl [6-carbamoyl-2-(3,5-dimethoxyphenyl)-9-(3-methoxyphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
ethyl [6-carbamoyl-2-(3,5-dimethoxyphenyl)-9-(3-methoxyphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
Compound characteristics
| Compound ID: | C429-1028 |
| Compound Name: | ethyl [6-carbamoyl-2-(3,5-dimethoxyphenyl)-9-(3-methoxyphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate |
| Molecular Weight: | 507.5 |
| Molecular Formula: | C25 H25 N5 O7 |
| Smiles: | CCOC(CN1C(N(c2cccc(c2)OC)c2c1c(C(N)=O)nc(c1cc(cc(c1)OC)OC)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7208 |
| logD: | 3.7208 |
| logSw: | -4.1725 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.868 |
| InChI Key: | VGHLNYPWKAITHW-UHFFFAOYSA-N |