Gsk417651A
TL;DR: Gsk417651A (CAS 736945-96-3) is a chemical compound with molecular formula C20H19N3O2S and molecular weight 365.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-methoxyanilino)-1,3-thiazol-4-yl]methanone
Also Known As: TRPC3/6-IN-1, GSK 417651A, GSK-417651A, compound 3 [PMID: 23886683], BAS 11101655
| Molecular Formula | C20H19N3O2S |
|---|---|
| Molecular Weight | 365.12 g/mol |
| LogP | 4.0938 |
| Topological Polar Surface Area | 54.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.1198 |
| Heavy Atoms | 26 |
| Complexity | 920.81555 |
Chemical Identifiers
| CAS Number | 736945-96-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)N3CCC4=CC=CC=C4C3 |
Product Overview
Gsk417651A (CAS 736945-96-3), with molecular formula C20H19N3O2S and molecular weight 365.12 g/mol. IUPAC: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(4-methoxyanilino)-1,3-thiazol-4-yl]methanone.
Chemical Property Profile of Gsk417651A
Property Insights of Gsk417651A
The XLogP value of 4.0938 indicates that Gsk417651A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.46 Ų, Gsk417651A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Gsk417651A has 1 hydrogen bond donor(s) and 5 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 Gsk417651A?
The CAS number of Gsk417651A is 736945-96-3.
What is the molecular formula of Gsk417651A?
The molecular formula of Gsk417651A is C20H19N3O2S.
What is the molecular weight of Gsk417651A?
The molecular weight of Gsk417651A is 365.12 g/mol.
Where can I buy Gsk417651A?
You can request a quote for Gsk417651A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gsk417651A?
Yes, KEHONG BIO provides custom synthesis services for Gsk417651A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.