1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate
TL;DR: 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate (CAS 70547-06-7) is a chemical compound with molecular formula C18H18ClNO3S2 and molecular weight 395.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-4-phenyl-1,2,3,4-tetrahydro-[1]benzothiolo[3,2-c]pyridine;methanesulfonic acid
Also Known As: 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate, (1)Benzothieno(3,2-c)pyridine, 1,2,3,4-tetrahydro-8-chloro-4-phenyl-, methanesulfonate, 8-Chloro-4-phenyl-1,2,3,4-tetrahydro-benzo(b)thieno(3,2-c)pyridine methanesulfonate, 8-chloro-4-phenyl-1,2,3,4-tetrahydro-[1]benzothiolo[3,2-c]pyridine; methanesulfonic acid, Methanesulfonic acid--8-chloro-4-phenyl-1,2,3,4-tetrahydro[1]benzothieno[3,2-c]pyridine (1/1)
| Molecular Formula | C18H18ClNO3S2 |
|---|---|
| Molecular Weight | 395.04 g/mol |
| LogP | 4.2938 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 395.04166 |
| Heavy Atoms | 25 |
| Complexity | 976.22876 |
Chemical Identifiers
| CAS Number | 70547-06-7 |
|---|---|
| SMILES | CS(=O)(=O)O.C1C(C2=C(CN1)C3=C(S2)C=CC(=C3)Cl)C4=CC=CC=C4 |
Product Overview
1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate (CAS 70547-06-7), with molecular formula C18H18ClNO3S2 and molecular weight 395.04 g/mol. IUPAC: 8-chloro-4-phenyl-1,2,3,4-tetrahydro-[1]benzothiolo[3,2-c]pyridine;methanesulfonic acid.
Chemical Property Profile of 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate
Property Insights of 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate
The XLogP value of 4.2938 indicates that 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate. Following Lipinski's Rule of Five, 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate has 2 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 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate?
The CAS number of 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate is 70547-06-7.
What is the molecular formula of 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate?
The molecular formula of 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate is C18H18ClNO3S2.
What is the molecular weight of 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate?
The molecular weight of 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate is 395.04 g/mol.
Where can I buy 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate?
You can request a quote for 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrahydro-8-chloro-4-phenyl-(1)benzothieno(3,2-c)pyridine methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.