![N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide structure](/static/products/956/956706-48-2.png)
N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide
TL;DR: N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide (CAS 956706-48-2) is a chemical compound with molecular formula C18H17F3N2O2 and molecular weight 350.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide
Also Known As: AB00724811-01, N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide
| Molecular Formula | C18H17F3N2O2 |
|---|---|
| Molecular Weight | 350.12 g/mol |
| LogP | 3.497 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.1242 |
| Heavy Atoms | 25 |
| Complexity | 793.6407 |
Chemical Identifiers
| CAS Number | 956706-48-2 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)NC1=CC(=C(C=C1)F)F)NC(=O)C2=CC=CC=C2F |
Product Overview
N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide (CAS 956706-48-2), with molecular formula C18H17F3N2O2 and molecular weight 350.12 g/mol. IUPAC: N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide.
Chemical Property Profile of N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide
Property Insights of N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide
The XLogP value of 3.497 indicates that N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide has 2 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 N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide?
The CAS number of N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide is 956706-48-2.
What is the molecular formula of N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide?
The molecular formula of N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide is C18H17F3N2O2.
What is the molecular weight of N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide?
The molecular weight of N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide is 350.12 g/mol.
Where can I buy N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide?
You can request a quote for N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2S)-1-(3,4-difluoroanilino)-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.