ethyl 3-methyl-5-(4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(1H)-sulfonyl)-1-benzofuran-2-carboxylate
Chemical Structure Depiction of
ethyl 3-methyl-5-(4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(1H)-sulfonyl)-1-benzofuran-2-carboxylate
ethyl 3-methyl-5-(4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(1H)-sulfonyl)-1-benzofuran-2-carboxylate
Compound characteristics
| Compound ID: | S020-0431 |
| Compound Name: | ethyl 3-methyl-5-(4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(1H)-sulfonyl)-1-benzofuran-2-carboxylate |
| Molecular Weight: | 417.44 |
| Molecular Formula: | C19 H19 N3 O6 S |
| Smiles: | [H]C1NC2CN(CCC=2C(N=1)=O)S(c1ccc2c(c1)c(C)c(C(=O)OCC)o2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9168 |
| logD: | 0.7223 |
| logSw: | -2.7796 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.637 |
| InChI Key: | LFOUVJUNUJTEDR-UHFFFAOYSA-N |