C22H17ClF3NO4
TL;DR: C22H17ClF3NO4 (CAS 577963-77-0) is a chemical compound with molecular formula C22H17ClF3NO4 and molecular weight 451.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl)oxy]acetamide
Also Known As: N-(4-chloro-3-(trifluoromethyl)phenyl)-2-((7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy)acetamide, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]acetamide, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl)oxy]acetamide
| Molecular Formula | C22H17ClF3NO4 |
|---|---|
| Molecular Weight | 451.08 g/mol |
| LogP | 5.27982 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 451.07983 |
| Heavy Atoms | 31 |
| Complexity | 1250.2053 |
Chemical Identifiers
| CAS Number | 577963-77-0 |
|---|---|
| SMILES | CC1=CC2=C(C3=C(CCC3)C(=O)O2)C(=C1)OCC(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F |
Product Overview
C22H17ClF3NO4 (CAS 577963-77-0), with molecular formula C22H17ClF3NO4 and molecular weight 451.08 g/mol. IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl)oxy]acetamide.
Chemical Property Profile of C22H17ClF3NO4
Property Insights of C22H17ClF3NO4
The XLogP value of 5.27982 indicates that C22H17ClF3NO4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.54 Ų falls within the moderate polarity range, balancing permeability and solubility for C22H17ClF3NO4. Following Lipinski's Rule of Five, C22H17ClF3NO4 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C22H17ClF3NO4?
The CAS number of C22H17ClF3NO4 is 577963-77-0.
What is the molecular formula of C22H17ClF3NO4?
The molecular formula of C22H17ClF3NO4 is C22H17ClF3NO4.
What is the molecular weight of C22H17ClF3NO4?
The molecular weight of C22H17ClF3NO4 is 451.08 g/mol.
Where can I buy C22H17ClF3NO4?
You can request a quote for C22H17ClF3NO4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C22H17ClF3NO4?
Yes, KEHONG BIO provides custom synthesis services for C22H17ClF3NO4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.