A1098/0051576
TL;DR: A1098/0051576 (CAS 339293-10-6) is a chemical compound with molecular formula C31H22Cl2FN3OS and molecular weight 573.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2,4-dichlorophenyl)-5-(3-fluoro-4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-4-(4-phenylphenyl)-1,3-thiazole
Also Known As: A1098/0051576, 2-[3-(2,4-dichlorophenyl)-5-(3-fluoro-4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-4-(4-phenylphenyl)-1,3-thiazole, 4-(biphenyl-4-yl)-2-[5-(2,4-dichlorophenyl)-3-(3-fluoro-4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole, 4-[1-(4-[1,1'-biphenyl]-4-yl-1,3-thiazol-2-yl)-5-(2,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-2-fluorophenyl methyl ether, 4-{[1,1'-BIPHENYL]-4-YL}-2-[5-(2,4-DICHLOROPHENYL)-3-(3-FLUORO-4-METHOXYPHENYL)-4,5-DIHYDRO-1H-PYRAZOL-1-YL]-1,3-THIAZOLE
| Molecular Formula | C31H22Cl2FN3OS |
|---|---|
| Molecular Weight | 573.08 g/mol |
| LogP | 9.2873 |
| Topological Polar Surface Area | 37.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 573.0845 |
| Heavy Atoms | 39 |
| Complexity | 1671.5913 |
Chemical Identifiers
| CAS Number | 339293-10-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN(C(C2)C3=C(C=C(C=C3)Cl)Cl)C4=NC(=CS4)C5=CC=C(C=C5)C6=CC=CC=C6)F |
Product Overview
A1098/0051576 (CAS 339293-10-6), with molecular formula C31H22Cl2FN3OS and molecular weight 573.08 g/mol. IUPAC: 2-[3-(2,4-dichlorophenyl)-5-(3-fluoro-4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-4-(4-phenylphenyl)-1,3-thiazole.
Chemical Property Profile of A1098/0051576
Property Insights of A1098/0051576
The XLogP value of 9.2873 indicates that A1098/0051576 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.72 Ų, A1098/0051576 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A1098/0051576 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 A1098/0051576?
The CAS number of A1098/0051576 is 339293-10-6.
What is the molecular formula of A1098/0051576?
The molecular formula of A1098/0051576 is C31H22Cl2FN3OS.
What is the molecular weight of A1098/0051576?
The molecular weight of A1098/0051576 is 573.08 g/mol.
Where can I buy A1098/0051576?
You can request a quote for A1098/0051576 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1098/0051576?
Yes, KEHONG BIO provides custom synthesis services for A1098/0051576 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.