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N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide structure
Fine Chemical

N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide

TL;DR: N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide (CAS 1041718-21-1) is a chemical compound with molecular formula C32H29FN2O6 and molecular weight 556.201 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide

Also Known As: N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide, N-[2-(1,3-benzodioxol-5-ylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl]-N-(2-fluorobenzyl)-2-phenylacetamide, N-{2-[(2H-1,3-Benzodioxol-5-yl)amino]-1-(3,4-dimethoxyphenyl)-2-oxoethyl}-N-[(2-fluorophenyl)methyl]-2-phenylacetamide, N-1,3-Benzodioxol-5-yl-I+/--[[(2-fluorophenyl)methyl](2-phenylacetyl)amino]-3,4-dimethoxybenzeneacetamide

CAS Number
1041718-21-1
Molecular Formula
C32H29FN2O6
Molecular Weight
556.201 g/mol
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Technical Specifications

Molecular FormulaC32H29FN2O6
Molecular Weight556.201 g/mol
XLogP5.3
Topological Polar Surface Area (TPSA)86.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors7
Rotatable Bonds10
Exact Mass556.201 Da
Heavy Atoms41
Complexity856.0
SMILESCOC1=C(C=C(C=C1)C(C(=O)NC2=CC3=C(C=C2)OCO3)N(CC4=CC=CC=C4F)C(=O)CC5=CC=CC=C5)OC
InChIKeyIDHAWEDITCOTKC-UHFFFAOYSA-N

Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide

XLogP
5.3
TPSA (Topological Polar Surface Area)
86.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
10
Heavy Atoms
41
Complexity
856.0
Exact Mass
556.201
Monoisotopic Mass
556.201
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-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide

The XLogP value of 5.3 indicates that N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide 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 N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide?

The CAS number of N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide is 1041718-21-1.

What is the molecular formula of N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide?

The molecular formula of N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide is C32H29FN2O6.

What is the molecular weight of N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide?

The molecular weight of N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide is 556.201 g/mol.

Where can I buy N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide?

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

Does CoreyChem offer custom synthesis for N-(1,3-benzodioxol-5-yl)-2-(3,4-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-(2-phenylacetyl)amino]acetamide?

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

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