methyl 4-[6-(5-chloro-2-hydroxyphenyl)-4-(4-ethoxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
Chemical Structure Depiction of
methyl 4-[6-(5-chloro-2-hydroxyphenyl)-4-(4-ethoxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
methyl 4-[6-(5-chloro-2-hydroxyphenyl)-4-(4-ethoxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
Compound characteristics
| Compound ID: | K915-1279 |
| Compound Name: | methyl 4-[6-(5-chloro-2-hydroxyphenyl)-4-(4-ethoxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate |
| Molecular Weight: | 464.95 |
| Molecular Formula: | C26 H25 Cl N2 O4 |
| Smiles: | CCOc1ccc(cc1)C1CC(c2cc(ccc2O)[Cl])NC(c2ccc(cc2)C(=O)OC)N=1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0052 |
| logD: | 5.9721 |
| logSw: | -6.008 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.46 |
| InChI Key: | FCOHFGLDBKZVQM-UHFFFAOYSA-N |