托非索泮
TL;DR: 托非索泮 (CAS 22345-47-7) is a chemical compound with molecular formula C22H26N2O4 and molecular weight 382.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
托非索泮
1-(3,4-dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine
Also Known As: tofisopam, Grandaxin, Emandaxin, tofizopam, Tofisopamum
| Molecular Formula | C22H26N2O4 |
|---|---|
| Molecular Weight | 382.19 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.18927 |
| Heavy Atoms | 28 |
| Complexity | 579.0 |
| Melting Point | 156.5 |
Chemical Identifiers
| CAS Number | 22345-47-7 |
|---|---|
| SMILES | CCC1C(=NN=C(C2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3)OC)OC)C |
| InChIKey | RUJBDQSFYCKFAA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
托非索泮 (CAS 22345-47-7), with molecular formula C22H26N2O4 and molecular weight 382.19 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine.
Chemical Property Profile of 托非索泮
Property Insights of 托非索泮
The XLogP value of 3.2 indicates that 托非索泮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 托非索泮. Following Lipinski's Rule of Five, 托非索泮 has 0 hydrogen bond donor(s) and 6 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 托非索泮?
The CAS number of 托非索泮 is 22345-47-7.
What is the molecular formula of 托非索泮?
The molecular formula of 托非索泮 is C22H26N2O4.
What is the molecular weight of 托非索泮?
The molecular weight of 托非索泮 is 382.19 g/mol.
Where can I buy 托非索泮?
You can request a quote for 托非索泮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 托非索泮?
Yes, KEHONG BIO provides custom synthesis services for 托非索泮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.