Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-
TL;DR: Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)- (CAS 119737-52-9) is a chemical compound with molecular formula C9H12N2O4 and molecular weight 212.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]butanoic acid
Also Known As: Z-4105, Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-, 4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]butanoic acid, 4-(3-Methylisoxazole-5-carboxamido)butanoic acid, 4-(3-Methyl-1,2-oxazole-5-carboxamido)butanoic acid
| Molecular Formula | C9H12N2O4 |
|---|---|
| Molecular Weight | 212.08 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.07971 |
| Heavy Atoms | 15 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 119737-52-9 |
|---|---|
| SMILES | CC1=NOC(=C1)C(=O)NCCCC(=O)O |
| InChIKey | QVLJRVUEXTYYQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)- (CAS 119737-52-9), with molecular formula C9H12N2O4 and molecular weight 212.08 g/mol. IUPAC: 4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]butanoic acid.
Chemical Property Profile of Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-
Property Insights of Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-. Following Lipinski's Rule of Five, Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)- has 2 hydrogen bond donor(s) and 5 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 Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-?
The CAS number of Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)- is 119737-52-9.
What is the molecular formula of Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-?
The molecular formula of Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)- is C9H12N2O4.
What is the molecular weight of Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-?
The molecular weight of Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)- is 212.08 g/mol.
Where can I buy Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-?
You can request a quote for Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 4-(((3-methyl-5-isoxazolyl)carbonyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.