N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide
TL;DR: N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide (CAS 646989-60-8) is a chemical compound with molecular formula C9H3BrCl3F2NO and molecular weight 362.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroprop-2-enamide
Also Known As: N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide, N-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroprop-2-enamide, 2-Propenamide, N-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloro-, N-(4-Bromo-2,6-difluorophenyl)-2,3,3-trichloro-2-propenamide
| Molecular Formula | C9H3BrCl3F2NO |
|---|---|
| Molecular Weight | 362.84 g/mol |
| LogP | 4.5513 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.84317 |
| Heavy Atoms | 17 |
| Complexity | 480.0095 |
Chemical Identifiers
| CAS Number | 646989-60-8 |
|---|---|
| SMILES | C1=C(C=C(C(=C1F)NC(=O)C(=C(Cl)Cl)Cl)F)Br |
Product Overview
N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide (CAS 646989-60-8), with molecular formula C9H3BrCl3F2NO and molecular weight 362.84 g/mol. IUPAC: N-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroprop-2-enamide.
Chemical Property Profile of N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide
Property Insights of N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide
The XLogP value of 4.5513 indicates that N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide has 1 hydrogen bond donor(s) and 1 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 N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide?
The CAS number of N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide is 646989-60-8.
What is the molecular formula of N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide?
The molecular formula of N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide is C9H3BrCl3F2NO.
What is the molecular weight of N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide?
The molecular weight of N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide is 362.84 g/mol.
Where can I buy N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide?
You can request a quote for N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide?
Yes, KEHONG BIO provides custom synthesis services for N1-(4-bromo-2,6-difluorophenyl)-2,3,3-trichloroacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.