![4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid structure](/static/products/4382/438221-98-8.webp)
4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid
TL;DR: 4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid (CAS 438221-98-8) is a chemical compound with molecular formula C14H13FN2O3S and molecular weight 308.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino]-4-oxobutanoic acid
Also Known As: Butanoic acid, 4-[[4-(4-fluorophenyl)-5-methyl-2-thiazolyl]amino]-4-oxo-, 4-{[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid, 3-[[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl]propanoic Acid, 4-[[4-(4-Fluorophenyl)-5-methyl-2-thiazolyl]amino]-4-oxobutanoic acid, 3-{N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]carbamoyl}propanoic acid
| Molecular Formula | C14H13FN2O3S |
|---|---|
| Molecular Weight | 308.06 g/mol |
| LogP | 3.06092 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.06308 |
| Heavy Atoms | 21 |
| Complexity | 667.3587 |
Chemical Identifiers
| CAS Number | 438221-98-8 |
|---|---|
| SMILES | CC1=C(N=C(S1)NC(=O)CCC(=O)O)C2=CC=C(C=C2)F |
Product Overview
4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid (CAS 438221-98-8), with molecular formula C14H13FN2O3S and molecular weight 308.06 g/mol. IUPAC: 4-[[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino]-4-oxobutanoic acid.
Chemical Property Profile of 4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid
Property Insights of 4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid
The XLogP value of 3.06092 indicates that 4-{[4-(4-Fluorophenyl)-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-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-{[4-(4-Fluorophenyl)-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-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid?
The CAS number of 4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid is 438221-98-8.
What is the molecular formula of 4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid?
The molecular formula of 4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid is C14H13FN2O3S.
What is the molecular weight of 4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid?
The molecular weight of 4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid is 308.06 g/mol.
Where can I buy 4-{[4-(4-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid?
You can request a quote for 4-{[4-(4-Fluorophenyl)-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-Fluorophenyl)-5-methyl-1,3-thiazol-2-yl]amino}-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[4-(4-Fluorophenyl)-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.