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C26H25ClN4O4S structure
Fine Chemical

C26H25ClN4O4S

TL;DR: C26H25ClN4O4S (CAS 1029014-53-6) is a chemical compound with molecular formula C26H25ClN4O4S and molecular weight 524.1285 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[1-[(2-chlorophenyl)methyl]benzimidazol-2-yl]sulfanyl-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]acetamide

Also Known As: 2-{[1-(2-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]acetohydrazide, (E)-2-((1-(2-chlorobenzyl)-1H-benzo[d]imidazol-2-yl)thio)-N'-(2,4,5-trimethoxybenzylidene)acetohydrazide

CAS Number
1029014-53-6
Molecular Formula
C26H25ClN4O4S
Molecular Weight
524.1285 g/mol
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Technical Specifications

Molecular FormulaC26H25ClN4O4S
Molecular Weight524.1285 g/mol
XLogP5.4
Topological Polar Surface Area (TPSA)112.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors7
Rotatable Bonds10
Exact Mass524.1285 Da
Heavy Atoms36
Complexity734.0
SMILESCOC1=CC(=C(C=C1/C=N/NC(=O)CSC2=NC3=CC=CC=C3N2CC4=CC=CC=C4Cl)OC)OC
InChIKeyCEAITNBSLRVVPD-CCVNUDIWSA-N

Chemical Property Profile of C26H25ClN4O4S

XLogP
5.4
TPSA (Topological Polar Surface Area)
112.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
10
Heavy Atoms
36
Complexity
734.0
Exact Mass
524.1285
Monoisotopic Mass
524.1285
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 C26H25ClN4O4S

The XLogP value of 5.4 indicates that C26H25ClN4O4S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C26H25ClN4O4S. Following Lipinski's Rule of Five, C26H25ClN4O4S has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of C26H25ClN4O4S?

The CAS number of C26H25ClN4O4S is 1029014-53-6.

What is the molecular formula of C26H25ClN4O4S?

The molecular formula of C26H25ClN4O4S is C26H25ClN4O4S.

What is the molecular weight of C26H25ClN4O4S?

The molecular weight of C26H25ClN4O4S is 524.1285 g/mol.

Where can I buy C26H25ClN4O4S?

You can request a quote for C26H25ClN4O4S directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for C26H25ClN4O4S?

Yes, CoreyChem provides custom synthesis services for C26H25ClN4O4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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