氟苯咪唑
TL;DR: 氟苯咪唑 (CAS 31430-15-6) is a chemical compound with molecular formula C16H12FN3O3 and molecular weight 313.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氟苯咪唑
methyl N-[6-(4-fluorobenzoyl)-1H-benzimidazol-2-yl]carbamate
Also Known As: Flubendazole, Flubendazol, Flumoxane, Fluvermal, Flubenol
| Molecular Formula | C16H12FN3O3 |
|---|---|
| Molecular Weight | 313.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 84.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.08627 |
| Heavy Atoms | 23 |
| Complexity | 454.0 |
| Melting Point | > 260 |
Chemical Identifiers
| CAS Number | 31430-15-6 |
|---|---|
| SMILES | COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=C(C=C3)F |
| InChIKey | CPEUVMUXAHMANV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氟苯咪唑 (CAS 31430-15-6), with molecular formula C16H12FN3O3 and molecular weight 313.09 g/mol. IUPAC: methyl N-[6-(4-fluorobenzoyl)-1H-benzimidazol-2-yl]carbamate.
Chemical Property Profile of 氟苯咪唑
Property Insights of 氟苯咪唑
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氟苯咪唑. The TPSA of 84.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 氟苯咪唑. Following Lipinski's Rule of Five, 氟苯咪唑 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 氟苯咪唑?
The CAS number of 氟苯咪唑 is 31430-15-6.
What is the molecular formula of 氟苯咪唑?
The molecular formula of 氟苯咪唑 is C16H12FN3O3.
What is the molecular weight of 氟苯咪唑?
The molecular weight of 氟苯咪唑 is 313.09 g/mol.
Where can I buy 氟苯咪唑?
You can request a quote for 氟苯咪唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氟苯咪唑?
Yes, KEHONG BIO provides custom synthesis services for 氟苯咪唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.