C15H14ClF9N2O
TL;DR: C15H14ClF9N2O (CAS 317840-70-3) is a chemical compound with molecular formula C15H14ClF9N2O and molecular weight 444.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[4-chloro-2-(trifluoromethyl)anilino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-methylbutanamide
Also Known As: N-(2-((4-chloro-2-(trifluoromethyl)phenyl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methylbutanamide, N-(2-{[4-chloro-2-(trifluoromethyl)phenyl]amino}-1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methylbutanamide, N-[2-[4-chloro-2-(trifluoromethyl)anilino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-methylbutanamide
| Molecular Formula | C15H14ClF9N2O |
|---|---|
| Molecular Weight | 444.07 g/mol |
| LogP | 5.7539 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.0651 |
| Heavy Atoms | 28 |
| Complexity | 698.93384 |
Chemical Identifiers
| CAS Number | 317840-70-3 |
|---|---|
| SMILES | CCC(C)C(=O)NC(C(F)(F)F)(C(F)(F)F)NC1=C(C=C(C=C1)Cl)C(F)(F)F |
Product Overview
C15H14ClF9N2O (CAS 317840-70-3), with molecular formula C15H14ClF9N2O and molecular weight 444.07 g/mol. IUPAC: N-[2-[4-chloro-2-(trifluoromethyl)anilino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-methylbutanamide.
Chemical Property Profile of C15H14ClF9N2O
Property Insights of C15H14ClF9N2O
The XLogP value of 5.7539 indicates that C15H14ClF9N2O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, C15H14ClF9N2O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C15H14ClF9N2O has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C15H14ClF9N2O?
The CAS number of C15H14ClF9N2O is 317840-70-3.
What is the molecular formula of C15H14ClF9N2O?
The molecular formula of C15H14ClF9N2O is C15H14ClF9N2O.
What is the molecular weight of C15H14ClF9N2O?
The molecular weight of C15H14ClF9N2O is 444.07 g/mol.
Where can I buy C15H14ClF9N2O?
You can request a quote for C15H14ClF9N2O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C15H14ClF9N2O?
Yes, KEHONG BIO provides custom synthesis services for C15H14ClF9N2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.