A3741/0158526
TL;DR: A3741/0158526 (CAS 727666-28-6) is a chemical compound with molecular formula C21H17F3N2O5S and molecular weight 466.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl]-2-oxochromene-6-sulfonamide
Also Known As: A3741/0158526, N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-2-oxo-2H-chromene-6-sulfonamide, N-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl]-2-oxochromene-6-sulfonamide
| Molecular Formula | C21H17F3N2O5S |
|---|---|
| Molecular Weight | 466.08 g/mol |
| LogP | 4.00232 |
| Topological Polar Surface Area | 101.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 466.08102 |
| Heavy Atoms | 32 |
| Complexity | 1472.5933 |
Chemical Identifiers
| CAS Number | 727666-28-6 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=CC(=C2)OC(F)(F)F)CCNS(=O)(=O)C3=CC4=C(C=C3)OC(=O)C=C4 |
Product Overview
A3741/0158526 (CAS 727666-28-6), with molecular formula C21H17F3N2O5S and molecular weight 466.08 g/mol. IUPAC: N-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl]-2-oxochromene-6-sulfonamide.
Chemical Property Profile of A3741/0158526
Property Insights of A3741/0158526
The XLogP value of 4.00232 indicates that A3741/0158526 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.4 Ų falls within the moderate polarity range, balancing permeability and solubility for A3741/0158526. Following Lipinski's Rule of Five, A3741/0158526 has 2 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 A3741/0158526?
The CAS number of A3741/0158526 is 727666-28-6.
What is the molecular formula of A3741/0158526?
The molecular formula of A3741/0158526 is C21H17F3N2O5S.
What is the molecular weight of A3741/0158526?
The molecular weight of A3741/0158526 is 466.08 g/mol.
Where can I buy A3741/0158526?
You can request a quote for A3741/0158526 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3741/0158526?
Yes, KEHONG BIO provides custom synthesis services for A3741/0158526 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.