F1691-1822
TL;DR: F1691-1822 (CAS 868147-72-2) is a chemical compound with molecular formula C21H19NO6S2 and molecular weight 445.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(5Z)-4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl]phenyl]acetic acid
Also Known As: F1691-1822, 2-{4-[(5Z)-4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl]phenyl}acetic acid, (Z)-2-(4-(4-oxo-2-thioxo-5-(3,4,5-trimethoxybenzylidene)thiazolidin-3-yl)phenyl)acetic acid, 2-[4-[(5Z)-4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl]phenyl]acetic acid, {p-[(Z)-4-oxo-2-thioxo-5-[(3,4,5-trimethoxyphenyl)methylene]-1,3-thiazolidin-3-yl]phenyl}acetic acid
| Molecular Formula | C21H19NO6S2 |
|---|---|
| Molecular Weight | 445.07 g/mol |
| LogP | 3.7453 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.06537 |
| Heavy Atoms | 30 |
| Complexity | 1007.2873 |
Chemical Identifiers
| CAS Number | 868147-72-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C\2/C(=O)N(C(=S)S2)C3=CC=C(C=C3)CC(=O)O |
Product Overview
F1691-1822 (CAS 868147-72-2), with molecular formula C21H19NO6S2 and molecular weight 445.07 g/mol. IUPAC: 2-[4-[(5Z)-4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl]phenyl]acetic acid.
Chemical Property Profile of F1691-1822
Property Insights of F1691-1822
The XLogP value of 3.7453 indicates that F1691-1822 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for F1691-1822. Following Lipinski's Rule of Five, F1691-1822 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1691-1822?
The CAS number of F1691-1822 is 868147-72-2.
What is the molecular formula of F1691-1822?
The molecular formula of F1691-1822 is C21H19NO6S2.
What is the molecular weight of F1691-1822?
The molecular weight of F1691-1822 is 445.07 g/mol.
Where can I buy F1691-1822?
You can request a quote for F1691-1822 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1691-1822?
Yes, KEHONG BIO provides custom synthesis services for F1691-1822 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.