F1691-1422
TL;DR: F1691-1422 (CAS 868147-52-8) is a chemical compound with molecular formula C15H18N2O3S2 and molecular weight 338.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5E)-5-[(1-methylpyrrol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
Also Known As: F1691-1422, (E)-2-(5-((1-methyl-1H-pyrrol-2-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid, 2-[(5E)-5-[(1-methylpyrrol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid, 2-[(5E)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid, 2-{5-[(1-methylpyrrol-2-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}hexa noic acid
| Molecular Formula | C15H18N2O3S2 |
|---|---|
| Molecular Weight | 338.08 g/mol |
| LogP | 2.8697 |
| Topological Polar Surface Area | 62.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.0759 |
| Heavy Atoms | 22 |
| Complexity | 636.487 |
Chemical Identifiers
| CAS Number | 868147-52-8 |
|---|---|
| SMILES | CCCCC(C(=O)O)N1C(=O)/C(=C\C2=CC=CN2C)/SC1=S |
Product Overview
F1691-1422 (CAS 868147-52-8), with molecular formula C15H18N2O3S2 and molecular weight 338.08 g/mol. IUPAC: 2-[(5E)-5-[(1-methylpyrrol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid.
Chemical Property Profile of F1691-1422
Property Insights of F1691-1422
The XLogP value of 2.8697 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1691-1422. The TPSA of 62.54 Ų falls within the moderate polarity range, balancing permeability and solubility for F1691-1422. Following Lipinski's Rule of Five, F1691-1422 has 1 hydrogen bond donor(s) and 4 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 F1691-1422?
The CAS number of F1691-1422 is 868147-52-8.
What is the molecular formula of F1691-1422?
The molecular formula of F1691-1422 is C15H18N2O3S2.
What is the molecular weight of F1691-1422?
The molecular weight of F1691-1422 is 338.08 g/mol.
Where can I buy F1691-1422?
You can request a quote for F1691-1422 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1691-1422?
Yes, KEHONG BIO provides custom synthesis services for F1691-1422 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.