EX-A14471
TL;DR: EX-A14471 (CAS 185629-22-5) is a chemical compound with molecular formula C23H26FNO4 and molecular weight 399.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
EX-A14471
3-fluoro-4-[[2-hydroxy-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)acetyl]amino]benzoic acid
Also Known As: BMS 961, BMS961, BMS 189961, EX-A14471, BMS 270394
| Molecular Formula | C23H26FNO4 |
|---|---|
| Molecular Weight | 399.18 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.1846 |
| Heavy Atoms | 29 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 185629-22-5 |
|---|---|
| SMILES | CC1(CCC(C2=C1C=CC(=C2)C(C(=O)NC3=C(C=C(C=C3)C(=O)O)F)O)(C)C)C |
| InChIKey | AANFHDFOMFRLLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
EX-A14471 (CAS 185629-22-5), with molecular formula C23H26FNO4 and molecular weight 399.18 g/mol. IUPAC: 3-fluoro-4-[[2-hydroxy-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)acetyl]amino]benzoic acid.
Chemical Property Profile of EX-A14471
Property Insights of EX-A14471
The XLogP value of 4.9 indicates that EX-A14471 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for EX-A14471. Following Lipinski's Rule of Five, EX-A14471 has 3 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 EX-A14471?
The CAS number of EX-A14471 is 185629-22-5.
What is the molecular formula of EX-A14471?
The molecular formula of EX-A14471 is C23H26FNO4.
What is the molecular weight of EX-A14471?
The molecular weight of EX-A14471 is 399.18 g/mol.
Where can I buy EX-A14471?
You can request a quote for EX-A14471 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EX-A14471?
Yes, KEHONG BIO provides custom synthesis services for EX-A14471 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.