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7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide structure
Fine Chemical

7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide

TL;DR: 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide (CAS 1005703-11-6) is a chemical compound with molecular formula C15H11BrClF2N3O2S and molecular weight 448.9412 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methylpyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide

Also Known As: 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide, 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methylpyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide, 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methylpyrazol-4-yl)methyl]benzothiophene-2-carboxamide

CAS Number
1005703-11-6
Molecular Formula
C15H11BrClF2N3O2S
Molecular Weight
448.9412 g/mol
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Technical Specifications

Molecular FormulaC15H11BrClF2N3O2S
Molecular Weight448.9412 g/mol
XLogP4.6
Topological Polar Surface Area (TPSA)84.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds5
Exact Mass448.9412 Da
Heavy Atoms25
Complexity496.0
SMILESCN1C=C(C=N1)CNC(=O)C2=C(C3=C(C=CC(=C3S2)Br)OC(F)F)Cl
InChIKeyZRAVGMGYZIXCDW-UHFFFAOYSA-N

Chemical Property Profile of 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide

XLogP
4.6
TPSA (Topological Polar Surface Area)
84.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
5
Heavy Atoms
25
Complexity
496.0
Exact Mass
448.9412
Monoisotopic Mass
448.9412
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 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide

The XLogP value of 4.6 indicates that 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide. Following Lipinski's Rule of Five, 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide?

The CAS number of 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide is 1005703-11-6.

What is the molecular formula of 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide?

The molecular formula of 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide is C15H11BrClF2N3O2S.

What is the molecular weight of 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide?

The molecular weight of 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide is 448.9412 g/mol.

Where can I buy 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide?

You can request a quote for 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide?

Yes, CoreyChem provides custom synthesis services for 7-bromo-3-chloro-4-(difluoromethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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