F1691-1945
TL;DR: F1691-1945 (CAS 853903-64-7) is a chemical compound with molecular formula C14H16N2O4S3 and molecular weight 372.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5Z)-5-[[4-(dimethylamino)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid
Also Known As: F1691-1945, 2-[(5Z)-5-{[4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethane-1-sulfonic acid, (Z)-2-(5-(4-(dimethylamino)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)ethanesulfonic acid, 2-(5-{[4-(dimethylamino)phenyl]methylene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl) ethanesulfonic acid, 2-[(5Z)-5-[(4-dimethylaminophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid
| Molecular Formula | C14H16N2O4S3 |
|---|---|
| Molecular Weight | 372.03 g/mol |
| LogP | 1.8416 |
| Topological Polar Surface Area | 77.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 372.02722 |
| Heavy Atoms | 23 |
| Complexity | 754.732 |
Chemical Identifiers
| CAS Number | 853903-64-7 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCS(=O)(=O)O |
Product Overview
F1691-1945 (CAS 853903-64-7), with molecular formula C14H16N2O4S3 and molecular weight 372.03 g/mol. IUPAC: 2-[(5Z)-5-[[4-(dimethylamino)phenyl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid.
Chemical Property Profile of F1691-1945
Property Insights of F1691-1945
The XLogP value of 1.8416 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1691-1945. The TPSA of 77.92 Ų falls within the moderate polarity range, balancing permeability and solubility for F1691-1945. Following Lipinski's Rule of Five, F1691-1945 has 1 hydrogen bond donor(s) and 6 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 F1691-1945?
The CAS number of F1691-1945 is 853903-64-7.
What is the molecular formula of F1691-1945?
The molecular formula of F1691-1945 is C14H16N2O4S3.
What is the molecular weight of F1691-1945?
The molecular weight of F1691-1945 is 372.03 g/mol.
Where can I buy F1691-1945?
You can request a quote for F1691-1945 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1691-1945?
Yes, KEHONG BIO provides custom synthesis services for F1691-1945 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.