(Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate
TL;DR: (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate (CAS 353472-48-7) is a chemical compound with molecular formula C19H13BrClNO5 and molecular weight 448.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(Z)-[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-chloro-6-methoxyphenyl] acetate
Also Known As: (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate, 5(4H)-oxazolone, 4-[[4-(acetyloxy)-3-chloro-5-methoxyphenyl]methylene]-2-(4-bromophenyl)-, (4Z)-, [4-[(Z)-[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-chloro-6-methoxyphenyl] acetate, 4-[(Z)-[2-(4-BROMOPHENYL)-5-OXO-1,3-OXAZOL-4(5H)-YLIDENE]METHYL]-2-CHLORO-6-METHOXYPHENYL ACETATE, 4-{(Z)-[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-chloro-6-methoxyphenyl acetate
| Molecular Formula | C19H13BrClNO5 |
|---|---|
| Molecular Weight | 448.97 g/mol |
| LogP | 4.3809 |
| Topological Polar Surface Area | 74.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.96655 |
| Heavy Atoms | 27 |
| Complexity | 982.33966 |
Chemical Identifiers
| CAS Number | 353472-48-7 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1Cl)/C=C\2/C(=O)OC(=N2)C3=CC=C(C=C3)Br)OC |
Product Overview
(Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate (CAS 353472-48-7), with molecular formula C19H13BrClNO5 and molecular weight 448.97 g/mol. IUPAC: [4-[(Z)-[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-chloro-6-methoxyphenyl] acetate.
Chemical Property Profile of (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate
Property Insights of (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate
The XLogP value of 4.3809 indicates that (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.19 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate. Following Lipinski's Rule of Five, (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate has 0 hydrogen bond donor(s) and 6 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 (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate?
The CAS number of (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate is 353472-48-7.
What is the molecular formula of (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate?
The molecular formula of (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate is C19H13BrClNO5.
What is the molecular weight of (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate?
The molecular weight of (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate is 448.97 g/mol.
Where can I buy (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate?
You can request a quote for (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-((2-(4-bromophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-chloro-6-methoxyphenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.