![4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid structure](/static/products/4382/438218-67-8.webp)
4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid
TL;DR: 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid (CAS 438218-67-8) is a chemical compound with molecular formula C18H22N2O3S and molecular weight 346.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]amino]-4-oxobutanoic acid
Also Known As: 4-{[4-(4-ISOBUTYLPHENYL)-5-METHYL-1,3-THIAZOL-2-YL]AMINO}-4-OXOBUTANOIC ACID, 4-((4-(4-isobutylphenyl)-5-methylthiazol-2-yl)amino)-4-oxobutanoic acid, 3-(N-{5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}carbamoyl)propano ic acid, 3-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]propanoic Acid, 4-({5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}amino)-4-oxobutanoic acid
| Molecular Formula | C18H22N2O3S |
|---|---|
| Molecular Weight | 346.14 g/mol |
| LogP | 4.12032 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 346.1351 |
| Heavy Atoms | 24 |
| Complexity | 720.3652 |
Chemical Identifiers
| CAS Number | 438218-67-8 |
|---|---|
| SMILES | CC1=C(N=C(S1)NC(=O)CCC(=O)O)C2=CC=C(C=C2)CC(C)C |
Product Overview
4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid (CAS 438218-67-8), with molecular formula C18H22N2O3S and molecular weight 346.14 g/mol. IUPAC: 4-[[5-methyl-4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]amino]-4-oxobutanoic acid.
Chemical Property Profile of 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid
Property Insights of 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid
The XLogP value of 4.12032 indicates that 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic 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 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic 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 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid?
The CAS number of 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid is 438218-67-8.
What is the molecular formula of 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid?
The molecular formula of 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid is C18H22N2O3S.
What is the molecular weight of 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid?
The molecular weight of 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid is 346.14 g/mol.
Where can I buy 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid?
You can request a quote for 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[4-(4-Isobutylphenyl)-5-methyl-1,3-thiazol-2-YL]amino}-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.