F1691-2585
TL;DR: F1691-2585 (CAS 880641-79-2) is a chemical compound with molecular formula C15H17NO4S3 and molecular weight 371.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5E)-5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid
Also Known As: F1691-2585, 2-[(5E)-5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethane-1-sulfonic acid, (E)-2-(5-(1-(3,4-dimethylphenyl)ethylidene)-4-oxo-2-thioxothiazolidin-3-yl)ethanesulfonic acid, 2-[(5E)-5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid, 2-{5-[(3,4-dimethylphenyl)ethylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}etha nesulfonic acid
| Molecular Formula | C15H17NO4S3 |
|---|---|
| Molecular Weight | 371.03 g/mol |
| LogP | 2.78254 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.03198 |
| Heavy Atoms | 23 |
| Complexity | 812.0109 |
Chemical Identifiers
| CAS Number | 880641-79-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)/C(=C/2\C(=O)N(C(=S)S2)CCS(=O)(=O)O)/C)C |
Product Overview
F1691-2585 (CAS 880641-79-2), with molecular formula C15H17NO4S3 and molecular weight 371.03 g/mol. IUPAC: 2-[(5E)-5-[1-(3,4-dimethylphenyl)ethylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid.
Chemical Property Profile of F1691-2585
Property Insights of F1691-2585
The XLogP value of 2.78254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1691-2585. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for F1691-2585. Following Lipinski's Rule of Five, F1691-2585 has 1 hydrogen bond donor(s) and 5 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 F1691-2585?
The CAS number of F1691-2585 is 880641-79-2.
What is the molecular formula of F1691-2585?
The molecular formula of F1691-2585 is C15H17NO4S3.
What is the molecular weight of F1691-2585?
The molecular weight of F1691-2585 is 371.03 g/mol.
Where can I buy F1691-2585?
You can request a quote for F1691-2585 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1691-2585?
Yes, KEHONG BIO provides custom synthesis services for F1691-2585 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.