苯佐他明
TL;DR: 苯佐他明 (CAS 17243-39-9) is a chemical compound with molecular formula C18H19N and molecular weight 249.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯佐他明
N-methyl-1-(1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)methanamine
Also Known As: BENZOCTAMINE, Benzoctamina, Benzoctaminum, Benzoktamina, Tacitin
| Molecular Formula | C18H19N |
|---|---|
| Molecular Weight | 249.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.15175 |
| Heavy Atoms | 19 |
| Complexity | 313.0 |
| Melting Point | 320-322 |
Chemical Identifiers
| CAS Number | 17243-39-9 |
|---|---|
| SMILES | CNCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24 |
| InChIKey | GNRXCIONJWKSEA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苯佐他明 (CAS 17243-39-9), with molecular formula C18H19N and molecular weight 249.15 g/mol. IUPAC: N-methyl-1-(1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)methanamine.
Chemical Property Profile of 苯佐他明
Property Insights of 苯佐他明
The XLogP value of 3.7 indicates that 苯佐他明 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 苯佐他明 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯佐他明 has 1 hydrogen bond donor(s) and 1 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 苯佐他明?
The CAS number of 苯佐他明 is 17243-39-9.
What is the molecular formula of 苯佐他明?
The molecular formula of 苯佐他明 is C18H19N.
What is the molecular weight of 苯佐他明?
The molecular weight of 苯佐他明 is 249.15 g/mol.
Where can I buy 苯佐他明?
You can request a quote for 苯佐他明 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯佐他明?
Yes, KEHONG BIO provides custom synthesis services for 苯佐他明 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.