2-苯基喹啉-3-甲酸
TL;DR: 2-苯基喹啉-3-甲酸 (CAS 133348-05-7) is a chemical compound with molecular formula C16H11NO2 and molecular weight 249.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-苯基喹啉-3-甲酸
2-phenylquinoline-3-carboxylic acid
Also Known As: carboxyphenylquinoline, 2-phenylquinoline-3-carboxylic acid
| Molecular Formula | C16H11NO2 |
|---|---|
| Molecular Weight | 249.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.07898 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 133348-05-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=C2C(=O)O |
| InChIKey | VXTYWQBVPQPTIY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-苯基喹啉-3-甲酸 (CAS 133348-05-7), with molecular formula C16H11NO2 and molecular weight 249.08 g/mol. IUPAC: 2-phenylquinoline-3-carboxylic acid.
Chemical Property Profile of 2-苯基喹啉-3-甲酸
Property Insights of 2-苯基喹啉-3-甲酸
The XLogP value of 3.4 indicates that 2-苯基喹啉-3-甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 2-苯基喹啉-3-甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-苯基喹啉-3-甲酸 has 1 hydrogen bond donor(s) and 3 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 2-苯基喹啉-3-甲酸?
The CAS number of 2-苯基喹啉-3-甲酸 is 133348-05-7.
What is the molecular formula of 2-苯基喹啉-3-甲酸?
The molecular formula of 2-苯基喹啉-3-甲酸 is C16H11NO2.
What is the molecular weight of 2-苯基喹啉-3-甲酸?
The molecular weight of 2-苯基喹啉-3-甲酸 is 249.08 g/mol.
Where can I buy 2-苯基喹啉-3-甲酸?
You can request a quote for 2-苯基喹啉-3-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-苯基喹啉-3-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 2-苯基喹啉-3-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.