Bisfentidine
TL;DR: Bisfentidine (CAS 96153-56-9) is a chemical compound with molecular formula C14H18N4 and molecular weight 242.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(2-methyl-1H-imidazol-5-yl)phenyl]-N'-propan-2-ylmethanimidamide
Also Known As: Bisfentidine, bisfentidina, Bisfentidine [INN], bisfentidinum, 4-Ethoxycarbonylphenylboronic acid
| Molecular Formula | C14H18N4 |
|---|---|
| Molecular Weight | 242.15 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.15315 |
| Heavy Atoms | 18 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 96153-56-9 |
|---|---|
| SMILES | CC1=NC=C(N1)C2=CC=C(C=C2)NC=NC(C)C |
| InChIKey | FXJAOWANXXJWGJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bisfentidine (CAS 96153-56-9), with molecular formula C14H18N4 and molecular weight 242.15 g/mol. IUPAC: N-[4-(2-methyl-1H-imidazol-5-yl)phenyl]-N'-propan-2-ylmethanimidamide.
Chemical Property Profile of Bisfentidine
Property Insights of Bisfentidine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bisfentidine. With a topological polar surface area (TPSA) of 53.1 Ų, Bisfentidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bisfentidine has 2 hydrogen bond donor(s) and 2 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 Bisfentidine?
The CAS number of Bisfentidine is 96153-56-9.
What is the molecular formula of Bisfentidine?
The molecular formula of Bisfentidine is C14H18N4.
What is the molecular weight of Bisfentidine?
The molecular weight of Bisfentidine is 242.15 g/mol.
Where can I buy Bisfentidine?
You can request a quote for Bisfentidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bisfentidine?
Yes, KEHONG BIO provides custom synthesis services for Bisfentidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.