N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide
TL;DR: N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide (CAS 477863-92-6) is a chemical compound with molecular formula C14H15F6NO3 and molecular weight 359.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-propan-2-yl-2,5-bis(2,2,2-trifluoroethoxy)benzamide
Also Known As: Bionet1_004173, DivK1c_002669, CDS1_001629, N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide, 12P-549S
| Molecular Formula | C14H15F6NO3 |
|---|---|
| Molecular Weight | 359.10 g/mol |
| LogP | 3.707 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.0956 |
| Heavy Atoms | 24 |
| Complexity | 568.6087 |
Chemical Identifiers
| CAS Number | 477863-92-6 |
|---|---|
| SMILES | CC(C)NC(=O)C1=C(C=CC(=C1)OCC(F)(F)F)OCC(F)(F)F |
Product Overview
N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide (CAS 477863-92-6), with molecular formula C14H15F6NO3 and molecular weight 359.10 g/mol. IUPAC: N-propan-2-yl-2,5-bis(2,2,2-trifluoroethoxy)benzamide.
Chemical Property Profile of N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide
Property Insights of N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide
The XLogP value of 3.707 indicates that N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide 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-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide?
The CAS number of N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide is 477863-92-6.
What is the molecular formula of N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide?
The molecular formula of N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide is C14H15F6NO3.
What is the molecular weight of N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide?
The molecular weight of N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide is 359.10 g/mol.
Where can I buy N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide?
You can request a quote for N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-isopropyl-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.