bis(2-methoxyethyl) 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
bis(2-methoxyethyl) 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
bis(2-methoxyethyl) 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 2556-2161 |
| Compound Name: | bis(2-methoxyethyl) 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 610.51 |
| Molecular Formula: | C30 H32 Br N3 O6 |
| Smiles: | CC1=C(C(C(=C(C)N1)C(=O)OCCOC)c1cn(c2ccccc2)nc1c1ccc(cc1)[Br])C(=O)OCCOC |
| Stereo: | ACHIRAL |
| logP: | 4.1548 |
| logD: | 0.1059 |
| logSw: | -4.2026 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.767 |
| InChI Key: | LNGNURYUBFVWPU-UHFFFAOYSA-N |