BAS 03563950
TL;DR: BAS 03563950 (CAS 432518-88-2) is a chemical compound with molecular formula C24H26N2O2S and molecular weight 406.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(furan-2-ylmethylsulfanyl)ethyl]benzamide
Also Known As: BAS 03563950, AH-487/40911555, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(furan-2-ylmethylsulfanyl)ethyl]benzamide, 4-(3,4-dihydro-2(1H)-isoquinolinylmethyl)-N-{2-[(2-furylmethyl)sulfanyl]ethyl}benzamide, 4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-N-{2-[(furan-2-ylmethyl)sulfanyl]ethyl}benzamide
| Molecular Formula | C24H26N2O2S |
|---|---|
| Molecular Weight | 406.17 g/mol |
| LogP | 4.5011 |
| Topological Polar Surface Area | 45.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 406.1715 |
| Heavy Atoms | 29 |
| Complexity | 922.3184 |
Chemical Identifiers
| CAS Number | 432518-88-2 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)NCCSCC4=CC=CO4 |
Product Overview
BAS 03563950 (CAS 432518-88-2), with molecular formula C24H26N2O2S and molecular weight 406.17 g/mol. IUPAC: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[2-(furan-2-ylmethylsulfanyl)ethyl]benzamide.
Chemical Property Profile of BAS 03563950
Property Insights of BAS 03563950
The XLogP value of 4.5011 indicates that BAS 03563950 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.48 Ų, BAS 03563950 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 03563950 has 1 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 BAS 03563950?
The CAS number of BAS 03563950 is 432518-88-2.
What is the molecular formula of BAS 03563950?
The molecular formula of BAS 03563950 is C24H26N2O2S.
What is the molecular weight of BAS 03563950?
The molecular weight of BAS 03563950 is 406.17 g/mol.
Where can I buy BAS 03563950?
You can request a quote for BAS 03563950 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03563950?
Yes, KEHONG BIO provides custom synthesis services for BAS 03563950 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.