BAS 03447781
TL;DR: BAS 03447781 (CAS 432539-75-8) is a chemical compound with molecular formula C16H20ClF3N2O3S and molecular weight 412.08 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-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide
Also Known As: BAS 03447781, AN-988/40889842, N-[2-chloro-5-(trifluoromethyl)phenyl]-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide, 2-{[2-chloro-5-(trifluoromethyl)phenyl](methylsulfonyl)amino}-1-(4-methylpiper idyl)ethan-1-one, N-[2-chloro-5-(trifluoromethyl)phenyl]-N-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]methanesulfonamide
| Molecular Formula | C16H20ClF3N2O3S |
|---|---|
| Molecular Weight | 412.08 g/mol |
| LogP | 3.3833 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.08353 |
| Heavy Atoms | 26 |
| Complexity | 775.43494 |
Chemical Identifiers
| CAS Number | 432539-75-8 |
|---|---|
| SMILES | CC1CCN(CC1)C(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C |
Product Overview
BAS 03447781 (CAS 432539-75-8), with molecular formula C16H20ClF3N2O3S and molecular weight 412.08 g/mol. IUPAC: N-[2-chloro-5-(trifluoromethyl)phenyl]-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]methanesulfonamide.
Chemical Property Profile of BAS 03447781
Property Insights of BAS 03447781
The XLogP value of 3.3833 indicates that BAS 03447781 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 03447781 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 03447781 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 03447781?
The CAS number of BAS 03447781 is 432539-75-8.
What is the molecular formula of BAS 03447781?
The molecular formula of BAS 03447781 is C16H20ClF3N2O3S.
What is the molecular weight of BAS 03447781?
The molecular weight of BAS 03447781 is 412.08 g/mol.
Where can I buy BAS 03447781?
You can request a quote for BAS 03447781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03447781?
Yes, KEHONG BIO provides custom synthesis services for BAS 03447781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.