N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide structure

N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide

TL;DR: N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide (CAS 852913-07-6) is a chemical compound with molecular formula C21H23N3O5 and molecular weight 397.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide

Also Known As: N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide, N'-[(2,6-Dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3(2H)-yl)butanehydrazide

CAS: 852913-07-6
Molecular Formula C21H23N3O5
Molecular Weight 397.16 g/mol
LogP 2.21794
Topological Polar Surface Area 102.57 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 397.16376
Heavy Atoms 29
Complexity 1063.1052

Chemical Identifiers

CAS Number 852913-07-6
SMILES CC1=C(C(=CC=C1)C)OCC(=O)NNC(=O)CCCN2C3=CC=CC=C3OC2=O

Product Overview

N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide (CAS 852913-07-6), with molecular formula C21H23N3O5 and molecular weight 397.16 g/mol. IUPAC: N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide

XLogP
2.21794
TPSA (Topological Polar Surface Area)
102.57
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
7
Heavy Atoms
29
Complexity
1063.1052
Exact Mass
397.16376
Monoisotopic Mass
397.16376
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'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide

The XLogP value of 2.21794 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide. The TPSA of 102.57 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide. Following Lipinski's Rule of Five, N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide has 2 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 typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide?

The CAS number of N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide is 852913-07-6.

What is the molecular formula of N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide?

The molecular formula of N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide is C21H23N3O5.

What is the molecular weight of N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide?

The molecular weight of N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide is 397.16 g/mol.

Where can I buy N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide?

You can request a quote for N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide?

Yes, KEHONG BIO provides custom synthesis services for N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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