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5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide structure
Fine Chemical

5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide

TL;DR: 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide (CAS 1022112-23-7) is a chemical compound with molecular formula C34H41Cl2N3O4S and molecular weight 657.2195 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-[2-[(3,5-dichlorophenoxy)methyl]-1,3-thiazol-4-yl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methylpyrrole-3-carboxamide

Also Known As: 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide, 5-[2-[(3,5-dichlorophenoxy)methyl]-1,3-thiazol-4-yl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methylpyrrole-3-carboxamide

CAS Number
1022112-23-7
Molecular Formula
C34H41Cl2N3O4S
Molecular Weight
657.2195 g/mol
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Technical Specifications

Molecular FormulaC34H41Cl2N3O4S
Molecular Weight657.2195 g/mol
XLogP8.8
Topological Polar Surface Area (TPSA)103.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds16
Exact Mass657.2195 Da
Heavy Atoms44
Complexity851.0
SMILESCCCCC(CC)CNC(=O)C1=C(N(C(=C1)C2=CSC(=N2)COC3=CC(=CC(=C3)Cl)Cl)CCC4=CC(=C(C=C4)OC)OC)C
InChIKeySNCQGHAAFDEHNS-UHFFFAOYSA-N

Chemical Property Profile of 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide

XLogP
8.8
TPSA (Topological Polar Surface Area)
103.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
16
Heavy Atoms
44
Complexity
851.0
Exact Mass
657.2195
Monoisotopic Mass
657.2195
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 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide

The XLogP value of 8.8 indicates that 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide. Following Lipinski's Rule of Five, 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide?

The CAS number of 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide is 1022112-23-7.

What is the molecular formula of 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide?

The molecular formula of 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide is C34H41Cl2N3O4S.

What is the molecular weight of 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide?

The molecular weight of 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide is 657.2195 g/mol.

Where can I buy 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide?

You can request a quote for 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide?

Yes, CoreyChem provides custom synthesis services for 5-[2-[(3,5-Dichlorophenoxy)methyl]-4-thiazolyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-ethylhexyl)-2-methyl-1H-pyrrole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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