J2.770.468I
TL;DR: J2.770.468I (CAS 1262518-84-2) is a chemical compound with molecular formula C22H12F3NO4S2 and molecular weight 475.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[(Z)-[4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid
Also Known As: J2.770.468I, 3-(5-((4-oxo-2-thioxo-3-(3-(trifluoromethyl)phenyl)thiazolidin-5-ylidene)methyl)furan-2-yl)benzoic acid, (Z)-3-(5-((4-Oxo-2-thioxo-3-(3-(trifluoromethyl)phenyl)thiazolidin-5-ylidene)methyl)furan-2-yl)benzoic acid, 3-[5-({4-OXO-2-SULFANYLIDENE-3-[3-(TRIFLUOROMETHYL)PHENYL]-1,3-THIAZOLIDIN-5-YLIDENE}METHYL)FURAN-2-YL]BENZOIC ACID, 3-[5-({4-oxo-2-thioxo-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl)-2-furyl]benzoic acid
| Molecular Formula | C22H12F3NO4S2 |
|---|---|
| Molecular Weight | 475.02 g/mol |
| LogP | 6.0694 |
| Topological Polar Surface Area | 70.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 475.016 |
| Heavy Atoms | 32 |
| Complexity | 1279.9304 |
Chemical Identifiers
| CAS Number | 1262518-84-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)O)C2=CC=C(O2)/C=C\3/C(=O)N(C(=S)S3)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
J2.770.468I (CAS 1262518-84-2), with molecular formula C22H12F3NO4S2 and molecular weight 475.02 g/mol. IUPAC: 3-[5-[(Z)-[4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of J2.770.468I
Property Insights of J2.770.468I
The XLogP value of 6.0694 indicates that J2.770.468I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.75 Ų falls within the moderate polarity range, balancing permeability and solubility for J2.770.468I. Following Lipinski's Rule of Five, J2.770.468I has 1 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 J2.770.468I?
The CAS number of J2.770.468I is 1262518-84-2.
What is the molecular formula of J2.770.468I?
The molecular formula of J2.770.468I is C22H12F3NO4S2.
What is the molecular weight of J2.770.468I?
The molecular weight of J2.770.468I is 475.02 g/mol.
Where can I buy J2.770.468I?
You can request a quote for J2.770.468I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J2.770.468I?
Yes, KEHONG BIO provides custom synthesis services for J2.770.468I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.