溴化替美吡铵
TL;DR: 溴化替美吡铵 (CAS 36063-64-6) is a chemical compound with molecular formula C17H22BrNOS2 and molecular weight 399.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
溴化替美吡铵
3-(dithiophen-2-ylmethylidene)-5-methoxy-1,1-dimethylpiperidin-1-ium bromide
Also Known As: timepidium bromide, Sesden, Timepidii bromidum, Bromuro de timepidio, Timepidium
| Molecular Formula | C17H22BrNOS2 |
|---|---|
| Molecular Weight | 399.03 g/mol |
| LogP | 1.1106 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.03262 |
| Heavy Atoms | 22 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 36063-64-6 |
|---|---|
| SMILES | C[N+]1(CC(CC(=C(C2=CC=CS2)C3=CC=CS3)C1)OC)C.[Br-] |
| InChIKey | QTSXMEPZSHLZFF-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
溴化替美吡铵 (CAS 36063-64-6), with molecular formula C17H22BrNOS2 and molecular weight 399.03 g/mol. IUPAC: 3-(dithiophen-2-ylmethylidene)-5-methoxy-1,1-dimethylpiperidin-1-ium bromide.
Chemical Property Profile of 溴化替美吡铵
Property Insights of 溴化替美吡铵
The XLogP value of 1.1106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 溴化替美吡铵. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 溴化替美吡铵. Following Lipinski's Rule of Five, 溴化替美吡铵 has 0 hydrogen bond donor(s) and 4 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 溴化替美吡铵?
The CAS number of 溴化替美吡铵 is 36063-64-6.
What is the molecular formula of 溴化替美吡铵?
The molecular formula of 溴化替美吡铵 is C17H22BrNOS2.
What is the molecular weight of 溴化替美吡铵?
The molecular weight of 溴化替美吡铵 is 399.03 g/mol.
Where can I buy 溴化替美吡铵?
You can request a quote for 溴化替美吡铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 溴化替美吡铵?
Yes, KEHONG BIO provides custom synthesis services for 溴化替美吡铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.