methyl 4-[4-(4-chlorophenyl)-6-(3-ethoxy-2-hydroxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
Chemical Structure Depiction of
methyl 4-[4-(4-chlorophenyl)-6-(3-ethoxy-2-hydroxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
methyl 4-[4-(4-chlorophenyl)-6-(3-ethoxy-2-hydroxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
Compound characteristics
| Compound ID: | K915-1339 |
| Compound Name: | methyl 4-[4-(4-chlorophenyl)-6-(3-ethoxy-2-hydroxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate |
| Molecular Weight: | 464.95 |
| Molecular Formula: | C26 H25 Cl N2 O4 |
| Smiles: | CCOc1cccc(C2CC(c3ccc(cc3)[Cl])=NC(c3ccc(cc3)C(=O)OC)N2)c1O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9963 |
| logD: | 5.9573 |
| logSw: | -6.1007 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.477 |
| InChI Key: | ZWLHZMRPIXXSCN-UHFFFAOYSA-N |