![N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide structure](/static/products/586/586391-60-8.png)
N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide
TL;DR: N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide (CAS 586391-60-8) is a chemical compound with molecular formula C18H17BrN2O3 and molecular weight 388.04 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]-3-methylbutanamide
Also Known As: N-[(2E)-2-(3-bromo-4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-3-methylbutanamide, N-[(2Z)-2-(3-bromo-4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-3-methylbutanamide, N-[2-(3-bromo-4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-3-methylbutanamide
| Molecular Formula | C18H17BrN2O3 |
|---|---|
| Molecular Weight | 388.04 g/mol |
| LogP | 4.9475 |
| Topological Polar Surface Area | 75.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.04224 |
| Heavy Atoms | 24 |
| Complexity | 902.4153 |
Chemical Identifiers
| CAS Number | 586391-60-8 |
|---|---|
| SMILES | CC(C)CC(=O)NC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)O)Br |
Product Overview
N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide (CAS 586391-60-8), with molecular formula C18H17BrN2O3 and molecular weight 388.04 g/mol. IUPAC: N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide.
Chemical Property Profile of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide
Property Insights of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide
The XLogP value of 4.9475 indicates that N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide 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]-3-methylbutanamide. Following Lipinski's Rule of Five, N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide?
The CAS number of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide is 586391-60-8.
What is the molecular formula of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide?
The molecular formula of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide is C18H17BrN2O3.
What is the molecular weight of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide?
The molecular weight of N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide is 388.04 g/mol.
Where can I buy N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide?
You can request a quote for N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide 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]-3-methylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(3-bromo-4-hydroxyphenyl)-1,3-benzoxazol-5-yl]-3-methylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.