3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
TL;DR: 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid (CAS 5134-06-5) is a chemical compound with molecular formula C23H22N2O3S and molecular weight 406.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-butan-2-yl-2-phenylmethoxyphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
Also Known As: 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid, 3-(5-butan-2-yl-2-phenylmethoxyphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
| Molecular Formula | C23H22N2O3S |
|---|---|
| Molecular Weight | 406.14 g/mol |
| LogP | 5.8535 |
| Topological Polar Surface Area | 63.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 406.1351 |
| Heavy Atoms | 29 |
| Complexity | 1147.6168 |
Chemical Identifiers
| CAS Number | 5134-06-5 |
|---|---|
| SMILES | CCC(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CSC4=NC(=CN34)C(=O)O |
Product Overview
3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid (CAS 5134-06-5), with molecular formula C23H22N2O3S and molecular weight 406.14 g/mol. IUPAC: 3-(5-butan-2-yl-2-phenylmethoxyphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid.
Chemical Property Profile of 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
Property Insights of 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
The XLogP value of 5.8535 indicates that 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid. Following Lipinski's Rule of Five, 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid?
The CAS number of 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid is 5134-06-5.
What is the molecular formula of 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid?
The molecular formula of 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid is C23H22N2O3S.
What is the molecular weight of 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid?
The molecular weight of 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid is 406.14 g/mol.
Where can I buy 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid?
You can request a quote for 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(Benzyloxy)-5-(butan-2-yl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.