Ximoprofen
TL;DR: Ximoprofen (CAS 56187-89-4) is a chemical compound with molecular formula C15H19NO3 and molecular weight 261.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-hydroxyiminocyclohexyl)phenyl]propanoic acid
Also Known As: Ximoprofen, Ximoprofene, Ximoprofeno, Ximoprofenum, Ximoprofen [INN]
| Molecular Formula | C15H19NO3 |
|---|---|
| Molecular Weight | 261.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.1365 |
| Heavy Atoms | 19 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 56187-89-4 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)C2CCCC(=NO)C2)C(=O)O |
| InChIKey | IQPPOXSMSDPZKU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ximoprofen (CAS 56187-89-4), with molecular formula C15H19NO3 and molecular weight 261.14 g/mol. IUPAC: 2-[4-(3-hydroxyiminocyclohexyl)phenyl]propanoic acid.
Chemical Property Profile of Ximoprofen
Property Insights of Ximoprofen
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ximoprofen. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ximoprofen. Following Lipinski's Rule of Five, Ximoprofen has 2 hydrogen bond donor(s) and 4 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 Ximoprofen?
The CAS number of Ximoprofen is 56187-89-4.
What is the molecular formula of Ximoprofen?
The molecular formula of Ximoprofen is C15H19NO3.
What is the molecular weight of Ximoprofen?
The molecular weight of Ximoprofen is 261.14 g/mol.
Where can I buy Ximoprofen?
You can request a quote for Ximoprofen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ximoprofen?
Yes, KEHONG BIO provides custom synthesis services for Ximoprofen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.