TL;DR: RH 8826 (CAS 143502-47-0) is a chemical compound with molecular formula C15H9ClF3NO6S and molecular weight 422.97913 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Benzoic acid, 5-((2-chloro-4-(trifluoromethyl)phenyl)sulfonyl)-2-nitro-, methyl ester
methyl 5-[2-chloro-4-(trifluoromethyl)phenyl]sulfonyl-2-nitrobenzoate
Also Known As: RH 8826, Benzoic acid, 5-((2-chloro-4-(trifluoromethyl)phenyl)sulfonyl)-2-nitro-, methyl ester, Methyl 5-[2-chloro-4-(trifluoromethyl)benzene-1-sulfonyl]-2-nitrobenzoate, methyl 5-[2-chloro-4-(trifluoromethyl)benzenesulfonyl]-2-nitrobenzoate, Methyl 5-[2-chloro-4-(trifluoromethyl)phenyl]sulfonyl-2-nitro-benzoate
| Molecular Formula | C15H9ClF3NO6S |
| Molecular Weight | 422.97913 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.97913 Da |
| Heavy Atoms | 27 |
| Complexity | 675.0 |
| SMILES | COC(=O)C1=C(C=CC(=C1)S(=O)(=O)C2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-] |
| InChIKey | WLIGHSWNRKCQBI-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that RH 8826 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RH 8826. Following Lipinski's Rule of Five, RH 8826 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RH 8826 is 143502-47-0.
The molecular formula of RH 8826 is C15H9ClF3NO6S.
The molecular weight of RH 8826 is 422.97913 g/mol.
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