N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide
TL;DR: N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide (CAS 477863-91-5) is a chemical compound with molecular formula C12H11F6NO3 and molecular weight 331.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide
Also Known As: N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide, N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide
| Molecular Formula | C12H11F6NO3 |
|---|---|
| Molecular Weight | 331.06 g/mol |
| LogP | 2.9284 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.0643 |
| Heavy Atoms | 22 |
| Complexity | 526.57336 |
Chemical Identifiers
| CAS Number | 477863-91-5 |
|---|---|
| SMILES | CNC(=O)C1=C(C=CC(=C1)OCC(F)(F)F)OCC(F)(F)F |
Product Overview
N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide (CAS 477863-91-5), with molecular formula C12H11F6NO3 and molecular weight 331.06 g/mol. IUPAC: N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide.
Chemical Property Profile of N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide
Property Insights of N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide
The XLogP value of 2.9284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide. With a topological polar surface area (TPSA) of 47.56 Ų, N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide has 1 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 N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide?
The CAS number of N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide is 477863-91-5.
What is the molecular formula of N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide?
The molecular formula of N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide is C12H11F6NO3.
What is the molecular weight of N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide?
The molecular weight of N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide is 331.06 g/mol.
Where can I buy N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide?
You can request a quote for N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-2,5-bis(2,2,2-trifluoroethoxy)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.