2G-053
TL;DR: 2G-053 (CAS 477710-60-4) is a chemical compound with molecular formula C19H9Cl2F3N4O2 and molecular weight 452.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-[3-[3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2-oxazol-5-yl]pyrazol-1-yl]methanone
Also Known As: 2G-053, (4-chlorophenyl)-[3-[3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1,2-oxazol-5-yl]pyrazol-1-yl]methanone, (4-chlorophenyl)(3-{3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-isoxazolyl}-1H-pyrazol-1-yl)methanone, (3-(3-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)isoxazol-5-yl)-1H-pyrazol-1-yl)(4-chlorophenyl)methanone, 3-chloro-2-{5-[1-(4-chlorobenzoyl)-1H-pyrazol-3-yl]-1,2-oxazol-3-yl}-5-(trifluoromethyl)pyridine
| Molecular Formula | C19H9Cl2F3N4O2 |
|---|---|
| Molecular Weight | 452.01 g/mol |
| LogP | 5.6142 |
| Topological Polar Surface Area | 73.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 452.00546 |
| Heavy Atoms | 30 |
| Complexity | 1233.313 |
Chemical Identifiers
| CAS Number | 477710-60-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)N2C=CC(=N2)C3=CC(=NO3)C4=C(C=C(C=N4)C(F)(F)F)Cl)Cl |
Product Overview
2G-053 (CAS 477710-60-4), with molecular formula C19H9Cl2F3N4O2 and molecular weight 452.01 g/mol. IUPAC: (4-chlorophenyl)-[3-[3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2-oxazol-5-yl]pyrazol-1-yl]methanone.
Chemical Property Profile of 2G-053
Property Insights of 2G-053
The XLogP value of 5.6142 indicates that 2G-053 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 2G-053. Following Lipinski's Rule of Five, 2G-053 has 0 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 2G-053?
The CAS number of 2G-053 is 477710-60-4.
What is the molecular formula of 2G-053?
The molecular formula of 2G-053 is C19H9Cl2F3N4O2.
What is the molecular weight of 2G-053?
The molecular weight of 2G-053 is 452.01 g/mol.
Where can I buy 2G-053?
You can request a quote for 2G-053 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2G-053?
Yes, KEHONG BIO provides custom synthesis services for 2G-053 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.