9-(2H-1,3-benzodioxol-5-yl)-2-(4-ethoxyphenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(2H-1,3-benzodioxol-5-yl)-2-(4-ethoxyphenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
9-(2H-1,3-benzodioxol-5-yl)-2-(4-ethoxyphenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | G656-0328 |
| Compound Name: | 9-(2H-1,3-benzodioxol-5-yl)-2-(4-ethoxyphenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 433.42 |
| Molecular Formula: | C22 H19 N5 O5 |
| Smiles: | CCOc1ccc(cc1)c1nc(C(N)=O)c2c(n1)N(C(N2C)=O)c1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.6431 |
| logD: | 3.6431 |
| logSw: | -4.0075 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.083 |
| InChI Key: | GUHNTJPJJORWLQ-UHFFFAOYSA-N |