9P-736
TL;DR: 9P-736 (CAS 478248-69-0) is a chemical compound with molecular formula C22H14ClF3N4O3 and molecular weight 474.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-[1-(4-methoxyphenyl)triazol-4-yl]methanone
Also Known As: 9P-736, [3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]-[1-(4-methoxyphenyl)triazol-4-yl]methanone, (3-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}phenyl)[1-(4-methoxyphenyl)-1H-1,2,3-triazol-4-yl]methanone, 3-chloro-2-{3-[1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carbonyl]phenoxy}-5-(trifluoromethyl)pyridine
| Molecular Formula | C22H14ClF3N4O3 |
|---|---|
| Molecular Weight | 474.07 g/mol |
| LogP | 5.3664 |
| Topological Polar Surface Area | 79.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 474.07065 |
| Heavy Atoms | 33 |
| Complexity | 1306.9915 |
Chemical Identifiers
| CAS Number | 478248-69-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C=C(N=N2)C(=O)C3=CC(=CC=C3)OC4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
9P-736 (CAS 478248-69-0), with molecular formula C22H14ClF3N4O3 and molecular weight 474.07 g/mol. IUPAC: [3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-[1-(4-methoxyphenyl)triazol-4-yl]methanone.
Chemical Property Profile of 9P-736
Property Insights of 9P-736
The XLogP value of 5.3664 indicates that 9P-736 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 9P-736. Following Lipinski's Rule of Five, 9P-736 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9P-736?
The CAS number of 9P-736 is 478248-69-0.
What is the molecular formula of 9P-736?
The molecular formula of 9P-736 is C22H14ClF3N4O3.
What is the molecular weight of 9P-736?
The molecular weight of 9P-736 is 474.07 g/mol.
Where can I buy 9P-736?
You can request a quote for 9P-736 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9P-736?
Yes, KEHONG BIO provides custom synthesis services for 9P-736 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.