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(3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide structure
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(3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide

TL;DR: (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide (CAS 1024407-13-3) is a chemical compound with molecular formula C25H13Cl2F3N2OS2 and molecular weight 547.97986 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-chloro-N-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]phenyl]benzo[g][1]benzothiole-2-carboxamide

Also Known As: (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide, 3-chloro-N-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylphenyl]benzo[g][1]benzothiole-2-carboxamide, 3-chloro-N-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}phenyl)naphtho[1,2-b]thiophene-2-carboxamide, 3-chloro-N-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]phenyl]benzo[g]benzothiophene-2-carboxamide, C25H13Cl2F3N2OS2

CAS Number
1024407-13-3
Molecular Formula
C25H13Cl2F3N2OS2
Molecular Weight
547.97986 g/mol
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Technical Specifications

Molecular FormulaC25H13Cl2F3N2OS2
Molecular Weight547.97986 g/mol
XLogP8.8
Topological Polar Surface Area (TPSA)95.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors7
Rotatable Bonds4
Exact Mass547.97986 Da
Heavy Atoms35
Complexity755.0
SMILESC1=CC=C2C(=C1)C=CC3=C2SC(=C3Cl)C(=O)NC4=CC=C(C=C4)SC5=C(C=C(C=N5)C(F)(F)F)Cl
InChIKeyUOKPCCFBMCLVDJ-UHFFFAOYSA-N

Chemical Property Profile of (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide

XLogP
8.8
TPSA (Topological Polar Surface Area)
95.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
4
Heavy Atoms
35
Complexity
755.0
Exact Mass
547.97986
Monoisotopic Mass
547.97986
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 (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide

The XLogP value of 8.8 indicates that (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide. Following Lipinski's Rule of Five, (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide 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 (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide?

The CAS number of (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide is 1024407-13-3.

What is the molecular formula of (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide?

The molecular formula of (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide is C25H13Cl2F3N2OS2.

What is the molecular weight of (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide?

The molecular weight of (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide is 547.97986 g/mol.

Where can I buy (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide?

You can request a quote for (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide?

Yes, CoreyChem provides custom synthesis services for (3-chlorobenzo[g]benzo[b]thiophen-2-yl)-N-(4-(3-chloro-5-(trifluoromethyl)(2-pyridylthio))phenyl)formamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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