methyl 4-[6-(3-ethoxy-2-hydroxyphenyl)-4-(3-methoxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
Chemical Structure Depiction of
methyl 4-[6-(3-ethoxy-2-hydroxyphenyl)-4-(3-methoxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
methyl 4-[6-(3-ethoxy-2-hydroxyphenyl)-4-(3-methoxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
Compound characteristics
| Compound ID: | K915-1382 |
| Compound Name: | methyl 4-[6-(3-ethoxy-2-hydroxyphenyl)-4-(3-methoxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C27 H28 N2 O5 |
| Smiles: | CCOc1cccc(C2CC(c3cccc(c3)OC)=NC(c3ccc(cc3)C(=O)OC)N2)c1O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4379 |
| logD: | 5.2797 |
| logSw: | -5.3291 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.021 |
| InChI Key: | KXUOCGXHWTUTEN-UHFFFAOYSA-N |