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 2-chlorobenzoate
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 2-chlorobenzoate
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 2-chlorobenzoate
Compound characteristics
| Compound ID: | 5510-0904 |
| 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 2-chlorobenzoate |
| Molecular Weight: | 498 |
| Molecular Formula: | C25 H24 Cl N3 O4 S |
| Smiles: | CCOc1cc(ccc1OC(c1ccccc1[Cl])=O)C1Nc2c(C(=N1)O)c1CCN(C)Cc1s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3194 |
| logD: | 3.9426 |
| logSw: | -4.4853 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.694 |
| InChI Key: | XJIORAVYJZUKIU-JOCHJYFZSA-N |