2-ethoxy-4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)phenyl benzoate
Chemical Structure Depiction of
2-ethoxy-4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)phenyl benzoate
2-ethoxy-4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)phenyl benzoate
Compound characteristics
| Compound ID: | 6540-0026 |
| Compound Name: | 2-ethoxy-4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)phenyl benzoate |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C25 H25 N3 O4 S |
| Smiles: | CCOc1cc(ccc1OC(c1ccccc1)=O)C1Nc2c(C(=N1)O)c1CCN(C)Cc1s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4804 |
| logD: | 3.1035 |
| logSw: | -4.1857 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.694 |
| InChI Key: | GSNIHUCACCMHKJ-JOCHJYFZSA-N |