ASN 12741052
TL;DR: ASN 12741052 (CAS 878717-43-2) is a chemical compound with molecular formula C16H21ClF3N3O4S and molecular weight 443.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(2-morpholin-4-ylethyl)acetamide
Also Known As: ASN 12741052, 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(2-morpholin-4-ylethyl)acetamide, 2-[[4-Chloro-3-(trifluoromethyl)phenyl](methylsulfonyl)amino]-N-[2-(4-morpholinyl)ethyl]acetamide, N~2~-[4-Chloro-3-(trifluoromethyl)phenyl]-N~2~-(methanesulfonyl)-N-[2-(morpholin-4-yl)ethyl]glycinamide, N~2~-[4-chloro-3-(trifluoromethyl)phenyl]-N~2~-(methylsulfonyl)-N-[2-(morpholin-4-yl)ethyl]glycinamide
| Molecular Formula | C16H21ClF3N3O4S |
|---|---|
| Molecular Weight | 443.09 g/mol |
| LogP | 1.5732 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 443.08932 |
| Heavy Atoms | 28 |
| Complexity | 798.81445 |
Chemical Identifiers
| CAS Number | 878717-43-2 |
|---|---|
| SMILES | CS(=O)(=O)N(CC(=O)NCCN1CCOCC1)C2=CC(=C(C=C2)Cl)C(F)(F)F |
Product Overview
ASN 12741052 (CAS 878717-43-2), with molecular formula C16H21ClF3N3O4S and molecular weight 443.09 g/mol. IUPAC: 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(2-morpholin-4-ylethyl)acetamide.
Chemical Property Profile of ASN 12741052
Property Insights of ASN 12741052
The XLogP value of 1.5732 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 12741052. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 12741052. Following Lipinski's Rule of Five, ASN 12741052 has 1 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 ASN 12741052?
The CAS number of ASN 12741052 is 878717-43-2.
What is the molecular formula of ASN 12741052?
The molecular formula of ASN 12741052 is C16H21ClF3N3O4S.
What is the molecular weight of ASN 12741052?
The molecular weight of ASN 12741052 is 443.09 g/mol.
Where can I buy ASN 12741052?
You can request a quote for ASN 12741052 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 12741052?
Yes, KEHONG BIO provides custom synthesis services for ASN 12741052 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.