TL;DR: RefChem:272147 (CAS 110544-72-4) is a chemical compound with molecular formula C24H31F2NO5 and molecular weight 451.21704 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(2-methylpropyl) 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2-(difluoromethoxy)phenyl)-2,6-dimethyl-, bis(2-methylpropyl) ester, 2,6-Dimethyl-3,5-diisobutoxycarbonyl-4-(o-difluoromethoxyphenyl)-1,4-dihydropyridine, bis(2-methylpropyl) 4-[2-(difluoromethoxy)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, BRN 5650082
| Molecular Formula | C24H31F2NO5 |
| Molecular Weight | 451.21704 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 73.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 451.21704 Da |
| Heavy Atoms | 32 |
| Complexity | 699.0 |
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OCC(C)C)C2=CC=CC=C2OC(F)F)C(=O)OCC(C)C |
| InChIKey | ZBGSZKIIHJVPIT-UHFFFAOYSA-N |
The XLogP value of 5.7 indicates that RefChem:272147 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:272147. Following Lipinski's Rule of Five, RefChem:272147 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:272147 is 110544-72-4.
The molecular formula of RefChem:272147 is C24H31F2NO5.
The molecular weight of RefChem:272147 is 451.21704 g/mol.
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