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1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1) structure
Fine Chemical

1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1)

TL;DR: 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1) (CAS 131028-67-6) is a chemical compound with molecular formula C22H22F2N2O5S and molecular weight 464.12173 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[2-[bis(4-fluorophenyl)methoxy]ethylsulfanylmethyl]-5-methyl-1H-imidazole;oxalic acid

Also Known As: 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1), 4-[2-[bis(4-fluorophenyl)methoxy]ethylsulfanylmethyl]-5-methyl-1H-imidazole; oxalic acid, Oxalic acid--4-[({2-[bis(4-fluorophenyl)methoxy]ethyl}sulfanyl)methyl]-5-methyl-1H-imidazole (1/1)

CAS Number
131028-67-6
Molecular Formula
C22H22F2N2O5S
Molecular Weight
464.12173 g/mol
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Technical Specifications

Molecular FormulaC22H22F2N2O5S
Molecular Weight464.12173 g/mol
XLogP4.19132
Topological Polar Surface Area (TPSA)138.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors9
Rotatable Bonds9
Exact Mass464.12173 Da
Heavy Atoms32
Complexity451.0
SMILESCC1=C(N=CN1)CSCCOC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F.C(=O)(C(=O)O)O
InChIKeyJLVPGNFECAZGKR-UHFFFAOYSA-N

Chemical Property Profile of 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1)

XLogP
4.19132
TPSA (Topological Polar Surface Area)
138.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
9
Rotatable Bonds
9
Heavy Atoms
32
Complexity
451.0
Exact Mass
464.12173
Monoisotopic Mass
464.12173
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1)

The XLogP value of 4.19132 indicates that 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1). Following Lipinski's Rule of Five, 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1) has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1)?

The CAS number of 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1) is 131028-67-6.

What is the molecular formula of 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1)?

The molecular formula of 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1) is C22H22F2N2O5S.

What is the molecular weight of 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1)?

The molecular weight of 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1) is 464.12173 g/mol.

Where can I buy 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1)?

You can request a quote for 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1)?

Yes, CoreyChem provides custom synthesis services for 1H-Imidazole, 4-(((2-(bis(4-fluorophenyl)methoxy)ethyl)thio)methyl)-5-methyl-, ethanedioate, (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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