Vincantril
TL;DR: Vincantril (CAS 65285-58-7) is a chemical compound with molecular formula C14H13ClN2O and molecular weight 260.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-chloro-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraen-2-one
Also Known As: Vincantril, Vincantrilo, Vincantrilum, Vincantril [INN], Vincantrilum [INN-Latin]
| Molecular Formula | C14H13ClN2O |
|---|---|
| Molecular Weight | 260.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 260.07166 |
| Heavy Atoms | 18 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 65285-58-7 |
|---|---|
| SMILES | C1CC(=O)N2C3=C(C=C(C=C3)Cl)C4=C2C1NCC4 |
| InChIKey | KJRKCWPQTXNNOM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vincantril (CAS 65285-58-7), with molecular formula C14H13ClN2O and molecular weight 260.07 g/mol. IUPAC: 12-chloro-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraen-2-one.
Chemical Property Profile of Vincantril
Property Insights of Vincantril
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vincantril. With a topological polar surface area (TPSA) of 34.0 Ų, Vincantril exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vincantril has 1 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 Vincantril?
The CAS number of Vincantril is 65285-58-7.
What is the molecular formula of Vincantril?
The molecular formula of Vincantril is C14H13ClN2O.
What is the molecular weight of Vincantril?
The molecular weight of Vincantril is 260.07 g/mol.
Where can I buy Vincantril?
You can request a quote for Vincantril directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vincantril?
Yes, KEHONG BIO provides custom synthesis services for Vincantril and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.