BAS 06498689
TL;DR: BAS 06498689 (CAS 442867-58-5) is a chemical compound with molecular formula C15H18ClF3N2O3S and molecular weight 398.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-chloro-5-(trifluoromethyl)phenyl]-N-(2-oxo-2-piperidin-1-ylethyl)methanesulfonamide
Also Known As: BAS 06498689, N-[2-chloro-5-(trifluoromethyl)phenyl]-N-(2-oxo-2-piperidin-1-ylethyl)methanesulfonamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-N-[2-oxo-2-(piperidin-1-yl)ethyl]methanesulfonamide, 2-{[2-chloro-5-(trifluoromethyl)phenyl](methylsulfonyl)amino}-1-piperidylethan -1-one
| Molecular Formula | C15H18ClF3N2O3S |
|---|---|
| Molecular Weight | 398.07 g/mol |
| LogP | 3.1373 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.06787 |
| Heavy Atoms | 25 |
| Complexity | 746.8787 |
Chemical Identifiers
| CAS Number | 442867-58-5 |
|---|---|
| SMILES | CS(=O)(=O)N(CC(=O)N1CCCCC1)C2=C(C=CC(=C2)C(F)(F)F)Cl |
Product Overview
BAS 06498689 (CAS 442867-58-5), with molecular formula C15H18ClF3N2O3S and molecular weight 398.07 g/mol. IUPAC: N-[2-chloro-5-(trifluoromethyl)phenyl]-N-(2-oxo-2-piperidin-1-ylethyl)methanesulfonamide.
Chemical Property Profile of BAS 06498689
Property Insights of BAS 06498689
The XLogP value of 3.1373 indicates that BAS 06498689 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, BAS 06498689 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 06498689 has 0 hydrogen bond donor(s) and 3 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 06498689?
The CAS number of BAS 06498689 is 442867-58-5.
What is the molecular formula of BAS 06498689?
The molecular formula of BAS 06498689 is C15H18ClF3N2O3S.
What is the molecular weight of BAS 06498689?
The molecular weight of BAS 06498689 is 398.07 g/mol.
Where can I buy BAS 06498689?
You can request a quote for BAS 06498689 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06498689?
Yes, KEHONG BIO provides custom synthesis services for BAS 06498689 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.