10E-062
TL;DR: 10E-062 (CAS 242797-12-2) is a chemical compound with molecular formula C21H14ClF3N4O2 and molecular weight 446.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]anilino]methyl]-2H-phthalazin-1-one
Also Known As: 10E-062, 4-((3-((3-Chloro-5-(trifluoromethyl)-2-pyridinyl)oxy)anilino)methyl)-1(2H)-phthalazinone, 4-[[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]methyl]-2H-phthalazin-1-one, 4-[(3-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)methyl]-1(2H)-phthalazinone, 4-(((3-((3-Chloro-5-(trifluoromethyl)pyridin-2-yl)oxy)phenyl)amino)methyl)phthalazin-1(2H)-one
| Molecular Formula | C21H14ClF3N4O2 |
|---|---|
| Molecular Weight | 446.08 g/mol |
| LogP | 5.3947 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 446.07574 |
| Heavy Atoms | 31 |
| Complexity | 1307.7859 |
Chemical Identifiers
| CAS Number | 242797-12-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NNC2=O)CNC3=CC(=CC=C3)OC4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
10E-062 (CAS 242797-12-2), with molecular formula C21H14ClF3N4O2 and molecular weight 446.08 g/mol. IUPAC: 4-[[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]anilino]methyl]-2H-phthalazin-1-one.
Chemical Property Profile of 10E-062
Property Insights of 10E-062
The XLogP value of 5.3947 indicates that 10E-062 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 10E-062. Following Lipinski's Rule of Five, 10E-062 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 10E-062?
The CAS number of 10E-062 is 242797-12-2.
What is the molecular formula of 10E-062?
The molecular formula of 10E-062 is C21H14ClF3N4O2.
What is the molecular weight of 10E-062?
The molecular weight of 10E-062 is 446.08 g/mol.
Where can I buy 10E-062?
You can request a quote for 10E-062 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10E-062?
Yes, KEHONG BIO provides custom synthesis services for 10E-062 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.