![3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE structure](/static/products/558/5585-95-5.png)
3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE
TL;DR: 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE (CAS 5585-95-5) is a chemical compound with molecular formula C27H17BrN2O4 and molecular weight 512.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-bromophenyl) 4-[[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]iminomethyl]benzoate
Also Known As: 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE, (3-bromophenyl) 4-[[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]iminomethyl]benzoate, (3-bromophenyl) 4-[[(3Z)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]iminomethyl]benzoate, (3-bromophenyl) 4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]iminomethyl]benzoate, (3-bromophenyl) 4-[[3-(3H-benzooxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]iminomethyl]benzoate
| Molecular Formula | C27H17BrN2O4 |
|---|---|
| Molecular Weight | 512.04 g/mol |
| LogP | 6.9327 |
| Topological Polar Surface Area | 84.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 512.0372 |
| Heavy Atoms | 34 |
| Complexity | 1490.761 |
Chemical Identifiers
| CAS Number | 5585-95-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)N=CC4=CC=C(C=C4)C(=O)OC5=CC(=CC=C5)Br)O |
Product Overview
3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE (CAS 5585-95-5), with molecular formula C27H17BrN2O4 and molecular weight 512.04 g/mol. IUPAC: (3-bromophenyl) 4-[[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]iminomethyl]benzoate.
Chemical Property Profile of 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE
Property Insights of 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE
The XLogP value of 6.9327 indicates that 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE. Following Lipinski's Rule of Five, 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE?
The CAS number of 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE is 5585-95-5.
What is the molecular formula of 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE?
The molecular formula of 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE is C27H17BrN2O4.
What is the molecular weight of 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE?
The molecular weight of 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE is 512.04 g/mol.
Where can I buy 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE?
You can request a quote for 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE?
Yes, KEHONG BIO provides custom synthesis services for 3-BROMOPHENYL 4-[(E)-{[3-(1,3-BENZOXAZOL-2-YL)-4-HYDROXYPHENYL]IMINO}METHYL]BENZOATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.