BAS 05346926
TL;DR: BAS 05346926 (CAS 1008039-04-0) is a chemical compound with molecular formula C21H20N2O3S2 and molecular weight 412.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylphenyl)-2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
Also Known As: BAS 05346926, F1274-0111, A3677/0155934, N-(2-methylphenyl)-2-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide, N-(2-methylphenyl)-2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
| Molecular Formula | C21H20N2O3S2 |
|---|---|
| Molecular Weight | 412.09 g/mol |
| LogP | 3.81082 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.09152 |
| Heavy Atoms | 28 |
| Complexity | 1108.1941 |
Chemical Identifiers
| CAS Number | 1008039-04-0 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=CS4 |
Product Overview
BAS 05346926 (CAS 1008039-04-0), with molecular formula C21H20N2O3S2 and molecular weight 412.09 g/mol. IUPAC: N-(2-methylphenyl)-2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide.
Chemical Property Profile of BAS 05346926
Property Insights of BAS 05346926
The XLogP value of 3.81082 indicates that BAS 05346926 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05346926. Following Lipinski's Rule of Five, BAS 05346926 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 05346926?
The CAS number of BAS 05346926 is 1008039-04-0.
What is the molecular formula of BAS 05346926?
The molecular formula of BAS 05346926 is C21H20N2O3S2.
What is the molecular weight of BAS 05346926?
The molecular weight of BAS 05346926 is 412.09 g/mol.
Where can I buy BAS 05346926?
You can request a quote for BAS 05346926 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05346926?
Yes, KEHONG BIO provides custom synthesis services for BAS 05346926 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.