![(E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid structure](/static/products/3290/329042-66-2.webp)
(E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid
TL;DR: (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid (CAS 329042-66-2) is a chemical compound with molecular formula C13H9BrN2O3S and molecular weight 351.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid
Also Known As: (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid, 2-butenoic acid, 4-[[4-(4-bromophenyl)-2-thiazolyl]amino]-4-oxo-, (2E)-, 3-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamoyl]prop-2-enoic Acid, (2E)-3-{N-[4-(4-bromophenyl)(1,3-thiazol-2-yl)]carbamoyl}prop-2-enoic acid, (2E)-4-[[4-(4-BROMOPHENYL)-1,3-THIAZOL-2-YL]AMINO]-4-OXOBUT-2-ENOIC ACID
| Molecular Formula | C13H9BrN2O3S |
|---|---|
| Molecular Weight | 351.95 g/mol |
| LogP | 3.1519 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.95172 |
| Heavy Atoms | 20 |
| Complexity | 664.51074 |
Chemical Identifiers
| CAS Number | 329042-66-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CSC(=N2)NC(=O)/C=C/C(=O)O)Br |
Product Overview
(E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid (CAS 329042-66-2), with molecular formula C13H9BrN2O3S and molecular weight 351.95 g/mol. IUPAC: (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid.
Chemical Property Profile of (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid
Property Insights of (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid
The XLogP value of 3.1519 indicates that (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid 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 (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid?
The CAS number of (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid is 329042-66-2.
What is the molecular formula of (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid?
The molecular formula of (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid is C13H9BrN2O3S.
What is the molecular weight of (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid?
The molecular weight of (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid is 351.95 g/mol.
Where can I buy (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid?
You can request a quote for (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.