4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide
TL;DR: 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide (CAS 300576-76-5) is a chemical compound with molecular formula C17H16Br2N2OS and molecular weight 453.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-anilino-4-(4-bromophenyl)-1,3-thiazol-3-ium-3-yl]ethanol bromide
Also Known As: N-[4-(4-bromophenyl)-3-(2-hydroxyethyl)-1,3-thiazol-2(3H)-ylidene]benzenaminium bromide, F0058-0006, 4-(4-BROMOPHENYL)-3-(2-HYDROXYETHYL)-2-(PHENYLAMINO)-1,3-THIAZOL-3-IUM BROMIDE, 2-[2-anilino-4-(4-bromophenyl)-1,3-thiazol-3-ium-3-yl]ethanol;bromide, 4-(4-bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide
| Molecular Formula | C17H16Br2N2OS |
|---|---|
| Molecular Weight | 453.94 g/mol |
| LogP | 1.205 |
| Topological Polar Surface Area | 36.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.935 |
| Heavy Atoms | 23 |
| Complexity | 745.04474 |
Chemical Identifiers
| CAS Number | 300576-76-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=[N+](C(=CS2)C3=CC=C(C=C3)Br)CCO.[Br-] |
Product Overview
4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide (CAS 300576-76-5), with molecular formula C17H16Br2N2OS and molecular weight 453.94 g/mol. IUPAC: 2-[2-anilino-4-(4-bromophenyl)-1,3-thiazol-3-ium-3-yl]ethanol bromide.
Chemical Property Profile of 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide
Property Insights of 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide
The XLogP value of 1.205 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide. With a topological polar surface area (TPSA) of 36.14 Ų, 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide has 2 hydrogen bond donor(s) and 3 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 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide?
The CAS number of 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide is 300576-76-5.
What is the molecular formula of 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide?
The molecular formula of 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide is C17H16Br2N2OS.
What is the molecular weight of 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide?
The molecular weight of 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide is 453.94 g/mol.
Where can I buy 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide?
You can request a quote for 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Bromophenyl)-3-(2-hydroxyethyl)-2-(phenylamino)thiazol-3-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.