4-(2-苯氧基烟酰胺基)丁酸
TL;DR: 4-(2-苯氧基烟酰胺基)丁酸 (CAS 76988-04-0) is a chemical compound with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-苯氧基烟酰胺基)丁酸
4-[(2-phenoxypyridine-3-carbonyl)amino]butanoic acid
Also Known As: BUTYRIC ACID, 4-(2-PHENOXYNICOTINAMIDO)-, 4-[(2-phenoxypyridine-3-carbonyl)amino]butanoic acid, N-(2-Phenozynicotinoyl)-gamma-aminobutyric acid, 4-(2-Phenoxynicotinoylamino)butyric acid, 4-(2-PHENOXYNICOTINAMIDO)BUTYRIC ACID
| Molecular Formula | C16H16N2O4 |
|---|---|
| Molecular Weight | 300.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 88.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 300.111 |
| Heavy Atoms | 22 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 76988-04-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)NCCCC(=O)O |
| InChIKey | UUEFPAVJPHHQCG-UHFFFAOYSA-N |
Product Overview
4-(2-苯氧基烟酰胺基)丁酸 (CAS 76988-04-0), with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol. IUPAC: 4-[(2-phenoxypyridine-3-carbonyl)amino]butanoic acid.
Chemical Property Profile of 4-(2-苯氧基烟酰胺基)丁酸
Property Insights of 4-(2-苯氧基烟酰胺基)丁酸
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-苯氧基烟酰胺基)丁酸. The TPSA of 88.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-苯氧基烟酰胺基)丁酸. Following Lipinski's Rule of Five, 4-(2-苯氧基烟酰胺基)丁酸 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 4-(2-苯氧基烟酰胺基)丁酸?
The CAS number of 4-(2-苯氧基烟酰胺基)丁酸 is 76988-04-0.
What is the molecular formula of 4-(2-苯氧基烟酰胺基)丁酸?
The molecular formula of 4-(2-苯氧基烟酰胺基)丁酸 is C16H16N2O4.
What is the molecular weight of 4-(2-苯氧基烟酰胺基)丁酸?
The molecular weight of 4-(2-苯氧基烟酰胺基)丁酸 is 300.11 g/mol.
Where can I buy 4-(2-苯氧基烟酰胺基)丁酸?
You can request a quote for 4-(2-苯氧基烟酰胺基)丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-苯氧基烟酰胺基)丁酸?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-苯氧基烟酰胺基)丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.