methyl 4-[4-(3-bromophenyl)-6-(2-hydroxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
Chemical Structure Depiction of
methyl 4-[4-(3-bromophenyl)-6-(2-hydroxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
methyl 4-[4-(3-bromophenyl)-6-(2-hydroxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate
Compound characteristics
| Compound ID: | K915-1193 |
| Compound Name: | methyl 4-[4-(3-bromophenyl)-6-(2-hydroxyphenyl)-1,2,5,6-tetrahydropyrimidin-2-yl]benzoate |
| Molecular Weight: | 465.35 |
| Molecular Formula: | C24 H21 Br N2 O3 |
| Smiles: | COC(c1ccc(cc1)C1NC(CC(c2cccc(c2)[Br])=N1)c1ccccc1O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8194 |
| logD: | 5.7985 |
| logSw: | -5.4837 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.336 |
| InChI Key: | BDECXMPWBJFPOB-UHFFFAOYSA-N |