TL;DR: FR 75513 (CAS 14992-59-7) is a chemical compound with molecular formula C19H19NO7 and molecular weight 373.11615 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-O-methyl 1-O-propan-2-yl 4-hydroxy-6-methyl-2-(2-nitrophenyl)benzene-1,3-dicarboxylate
Also Known As: FR 75513, 6-(1-Methylethyl) 2-methyl 3-hydroxy-5-methyl-2'-nitro-(1,1'-biphenyl)-2,6-dicarboxylate, 3-O-methyl 1-O-propan-2-yl 4-hydroxy-6-methyl-2-(2-nitrophenyl)benzene-1,3-dicarboxylate, [1,1'-Biphenyl]-2,6-dicarboxylic acid, 3-hydroxy-5-methyl-2'-nitro-, 2-methyl 6-(1-methylethyl) ester, [1,1'-Biphenyl]-2,6-dicarboxylicacid, 3-hydroxy-5-methyl-2'-nitro-, 2-methyl 6-(1-methylethyl) ester
| Molecular Formula | C19H19NO7 |
| Molecular Weight | 373.11615 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 373.11615 Da |
| Heavy Atoms | 27 |
| Complexity | 559.0 |
| SMILES | CC1=CC(=C(C(=C1C(=O)OC(C)C)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC)O |
| InChIKey | XSAOKGZBHYQDNI-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that FR 75513 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for FR 75513. Following Lipinski's Rule of Five, FR 75513 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of FR 75513 is 14992-59-7.
The molecular formula of FR 75513 is C19H19NO7.
The molecular weight of FR 75513 is 373.11615 g/mol.
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