![N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide structure](/static/products/535/535948-28-8.png)
N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide
TL;DR: N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide (CAS 535948-28-8) is a chemical compound with molecular formula C21H15BrN2O3 and molecular weight 422.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide
Also Known As: N-[(2E)-2-(3-bromo-4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-2-methylbenzamide, N-[2-(3-bromo-4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-2-methylbenzamide
| Molecular Formula | C21H15BrN2O3 |
|---|---|
| Molecular Weight | 422.03 g/mol |
| LogP | 5.52362 |
| Topological Polar Surface Area | 75.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 422.0266 |
| Heavy Atoms | 27 |
| Complexity | 1167.2755 |
Chemical Identifiers
| CAS Number | 535948-28-8 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=C(C=C4)O)Br |
Product Overview
N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide (CAS 535948-28-8), with molecular formula C21H15BrN2O3 and molecular weight 422.03 g/mol. IUPAC: N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide.
Chemical Property Profile of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide
Property Insights of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide
The XLogP value of 5.52362 indicates that N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide. Following Lipinski's Rule of Five, N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide?
The CAS number of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide is 535948-28-8.
What is the molecular formula of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide?
The molecular formula of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide is C21H15BrN2O3.
What is the molecular weight of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide?
The molecular weight of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide is 422.03 g/mol.
Where can I buy N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide?
You can request a quote for N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-2-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.