4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1)
TL;DR: 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1) (CAS 171088-75-8) is a chemical compound with molecular formula C15H21N3O4S and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dihydro-1,3-thiazol-2-amine;4-(4-ethoxyanilino)-4-oxobutanoic acid
Also Known As: 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1), Butanoic acid, 4-((4-ethoxyphenyl)amino)-4-oxo-, compd. with 4,5-dihydro-2-thiazolamine (1:1), 4,5-dihydro-1,3-thiazol-2-amine; 4-(4-ethoxyanilino)-4-oxobutanoic acid, 4,5-dihydro-1,3-thiazol-2-amine;4-(4-ethoxyanilino)-4-oxobutanoic acid, 4-(4-Ethoxyanilino)-4-oxobutanoic acid--4,5-dihydro-1,3-thiazol-2-amine (1/1)
| Molecular Formula | C15H21N3O4S |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 1.9365 |
| Topological Polar Surface Area | 114.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.12527 |
| Heavy Atoms | 23 |
| Complexity | 546.1579 |
Chemical Identifiers
| CAS Number | 171088-75-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CCC(=O)O.C1CSC(=N1)N |
Product Overview
4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1) (CAS 171088-75-8), with molecular formula C15H21N3O4S and molecular weight 339.13 g/mol. IUPAC: 4,5-dihydro-1,3-thiazol-2-amine;4-(4-ethoxyanilino)-4-oxobutanoic acid.
Chemical Property Profile of 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1)
Property Insights of 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1)
The XLogP value of 1.9365 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1). The TPSA of 114.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1). Following Lipinski's Rule of Five, 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1) has 3 hydrogen bond donor(s) and 6 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-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1)?
The CAS number of 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1) is 171088-75-8.
What is the molecular formula of 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1)?
The molecular formula of 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1) is C15H21N3O4S.
What is the molecular weight of 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1)?
The molecular weight of 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1) is 339.13 g/mol.
Where can I buy 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1)?
You can request a quote for 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-Ethoxyphenyl)amino)-4-oxobutanoic acid compd. with 4,5-dihydro-2-thiazolamine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.