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N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide structure
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N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide

TL;DR: N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide (CAS 1025062-94-5) is a chemical compound with molecular formula C21H23ClN4O5 and molecular weight 446.1357 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(3-chlorophenyl)-2-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-3-oxopiperazine-1-carboxamide

Also Known As: N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide, N-(3-chlorophenyl)-2-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-3-oxopiperazine-1-carboxamide, N-(3-chlorophenyl)-2-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-3-oxo-1-piperazinecarboxamide, 2-[(2,5-Dimethoxy-phenylcarbamoyl)-methyl]-3-oxo-piperazine-1-carboxylic acid (3-chloro-phenyl)-amide, 2-[(2,5-Dimethoxy-phenylcarbamoyl)-methyl]-3-oxo-piperazine-1-carboxylic acid (3-chloro-phenyl)-amide

CAS Number
1025062-94-5
Molecular Formula
C21H23ClN4O5
Molecular Weight
446.1357 g/mol
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Technical Specifications

Molecular FormulaC21H23ClN4O5
Molecular Weight446.1357 g/mol
XLogP1.6
Topological Polar Surface Area (TPSA)109.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass446.1357 Da
Heavy Atoms31
Complexity651.0
SMILESCOC1=CC(=C(C=C1)OC)NC(=O)CC2C(=O)NCCN2C(=O)NC3=CC(=CC=C3)Cl
InChIKeyIJTPCSBOHGJHDM-UHFFFAOYSA-N

Chemical Property Profile of N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide

XLogP
1.6
TPSA (Topological Polar Surface Area)
109.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
31
Complexity
651.0
Exact Mass
446.1357
Monoisotopic Mass
446.1357
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 N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide

The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide?

The CAS number of N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide is 1025062-94-5.

What is the molecular formula of N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide?

The molecular formula of N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide is C21H23ClN4O5.

What is the molecular weight of N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide?

The molecular weight of N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide is 446.1357 g/mol.

Where can I buy N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide?

You can request a quote for N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide?

Yes, CoreyChem provides custom synthesis services for N-(3-chlorophenyl)-2-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}-3-oxopiperazine-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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