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Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano-
TL;DR: Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- (CAS 63035-03-0) is a chemical compound with molecular formula C11H6F6N2O and molecular weight 296.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,5-bis(trifluoromethyl)phenyl]-2-cyanoacetamide
Also Known As: Maybridge3_001032, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyanoacetamide, Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano-, IDI1_012419, J3.539.708F
| Molecular Formula | C11H6F6N2O |
|---|---|
| Molecular Weight | 296.04 g/mol |
| LogP | 3.57638 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.03842 |
| Heavy Atoms | 20 |
| Complexity | 523.2525 |
Chemical Identifiers
| CAS Number | 63035-03-0 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(F)(F)F)NC(=O)CC#N)C(F)(F)F |
Product Overview
Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- (CAS 63035-03-0), with molecular formula C11H6F6N2O and molecular weight 296.04 g/mol. IUPAC: N-[3,5-bis(trifluoromethyl)phenyl]-2-cyanoacetamide.
Chemical Property Profile of Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano-
Property Insights of Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano-
The XLogP value of 3.57638 indicates that Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- has 1 hydrogen bond donor(s) and 2 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 Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano-?
The CAS number of Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- is 63035-03-0.
What is the molecular formula of Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano-?
The molecular formula of Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- is C11H6F6N2O.
What is the molecular weight of Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano-?
The molecular weight of Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- is 296.04 g/mol.
Where can I buy Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano-?
You can request a quote for Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-cyano- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.