Clobenfurol hemisuccinate
TL;DR: Clobenfurol hemisuccinate (CAS 3607-35-0) is a chemical compound with molecular formula C19H15ClO5 and molecular weight 358.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-benzofuran-2-yl-(4-chlorophenyl)methoxy]-4-oxobutanoic acid
Also Known As: Clobenfurol hemisuccinate, Succinic acid, mono(alpha-2-benzofuranyl-p-chlorobenzyl) ester, M/H, 4-[(1-Benzofuran-2-yl)(4-chlorophenyl)methoxy]-4-oxobutanoic acid, 4-[1-benzofuran-2-yl-(4-chlorophenyl)methoxy]-4-oxobutanoic acid
| Molecular Formula | C19H15ClO5 |
|---|---|
| Molecular Weight | 358.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.0608 |
| Heavy Atoms | 25 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 3607-35-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(O2)C(C3=CC=C(C=C3)Cl)OC(=O)CCC(=O)O |
| InChIKey | XIRZHWFBGLWVFS-UHFFFAOYSA-N |
Product Overview
Clobenfurol hemisuccinate (CAS 3607-35-0), with molecular formula C19H15ClO5 and molecular weight 358.06 g/mol. IUPAC: 4-[1-benzofuran-2-yl-(4-chlorophenyl)methoxy]-4-oxobutanoic acid.
Chemical Property Profile of Clobenfurol hemisuccinate
Property Insights of Clobenfurol hemisuccinate
The XLogP value of 3.8 indicates that Clobenfurol hemisuccinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Clobenfurol hemisuccinate. Following Lipinski's Rule of Five, Clobenfurol hemisuccinate has 1 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 Clobenfurol hemisuccinate?
The CAS number of Clobenfurol hemisuccinate is 3607-35-0.
What is the molecular formula of Clobenfurol hemisuccinate?
The molecular formula of Clobenfurol hemisuccinate is C19H15ClO5.
What is the molecular weight of Clobenfurol hemisuccinate?
The molecular weight of Clobenfurol hemisuccinate is 358.06 g/mol.
Where can I buy Clobenfurol hemisuccinate?
You can request a quote for Clobenfurol hemisuccinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clobenfurol hemisuccinate?
Yes, KEHONG BIO provides custom synthesis services for Clobenfurol hemisuccinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.