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3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide structure
Fine Chemical

3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide

TL;DR: 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide (CAS 876713-98-3) is a chemical compound with molecular formula C16H21N3O4 and molecular weight 319.1532 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide

Also Known As: BAS 10135131, 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide, 3-(3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)-N-propylpropanamide, 3-[3-(3,4-dimethoxyphenyl)(1,2,4-oxadiazol-5-yl)]-N-propylpropanamide, 3-[3-(3,4-Dimethoxy-phenyl)-[1,2,4]oxadiazol-5-yl]-N-propyl-propionamide

CAS Number
876713-98-3
Molecular Formula
C16H21N3O4
Molecular Weight
319.1532 g/mol
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Technical Specifications

Molecular FormulaC16H21N3O4
Molecular Weight319.1532 g/mol
XLogP2.2
Topological Polar Surface Area (TPSA)86.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds8
Exact Mass319.1532 Da
Heavy Atoms23
Complexity369.0
SMILESCCCNC(=O)CCC1=NC(=NO1)C2=CC(=C(C=C2)OC)OC
InChIKeyMBGQWRBECYHGIR-UHFFFAOYSA-N

Chemical Property Profile of 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide

XLogP
2.2
TPSA (Topological Polar Surface Area)
86.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
8
Heavy Atoms
23
Complexity
369.0
Exact Mass
319.1532
Monoisotopic Mass
319.1532
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 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide

The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide. The TPSA of 86.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide. Following Lipinski's Rule of Five, 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide 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 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide?

The CAS number of 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide is 876713-98-3.

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

The molecular formula of 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide is C16H21N3O4.

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

The molecular weight of 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide is 319.1532 g/mol.

Where can I buy 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-propylpropanamide?

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

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

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

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