8-(diethylamino)-7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(diethylamino)-7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-(diethylamino)-7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8016-8317 |
| Compound Name: | 8-(diethylamino)-7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C21 H27 N5 O5 |
| Smiles: | CCN(CC)c1nc2c(C(N(C)C(N2C)=O)=O)n1CC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8539 |
| logD: | 2.8537 |
| logSw: | -3.2142 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.489 |
| InChI Key: | QGFLHHVORLKCMQ-UHFFFAOYSA-N |