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N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide structure
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N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide

TL;DR: N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide (CAS 1005631-90-2) is a chemical compound with molecular formula C20H20N4O5 and molecular weight 396.14337 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide

Also Known As: N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide, N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzamide, N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzamide

CAS Number
1005631-90-2
Molecular Formula
C20H20N4O5
Molecular Weight
396.14337 g/mol
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Technical Specifications

Molecular FormulaC20H20N4O5
Molecular Weight396.14337 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)111.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass396.14337 Da
Heavy Atoms29
Complexity572.0
SMILESCC1=CC(=NN1CC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)OC)OC)[N+](=O)[O-]
InChIKeyDJXASOQLKSVURJ-UHFFFAOYSA-N

Chemical Property Profile of N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide

XLogP
3.2
TPSA (Topological Polar Surface Area)
111.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
29
Complexity
572.0
Exact Mass
396.14337
Monoisotopic Mass
396.14337
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-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide

The XLogP value of 3.2 indicates that N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide. Following Lipinski's Rule of Five, N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide 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 N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide?

The CAS number of N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide is 1005631-90-2.

What is the molecular formula of N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide?

The molecular formula of N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide is C20H20N4O5.

What is the molecular weight of N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide?

The molecular weight of N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide is 396.14337 g/mol.

Where can I buy N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide?

You can request a quote for N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide?

Yes, CoreyChem provides custom synthesis services for N-(3,4-dimethoxyphenyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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