F1691-1481
TL;DR: F1691-1481 (CAS 853903-62-5) is a chemical compound with molecular formula C14H13NO6S3 and molecular weight 386.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5Z)-5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid
Also Known As: F1691-1481, 2-[(5Z)-5-{[4-(methoxycarbonyl)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethane-1-sulfonic acid, (Z)-2-(5-(4-(methoxycarbonyl)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)ethanesulfonic acid, 2-[(5Z)-5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid, 2-(5-{[4-(methoxycarbonyl)phenyl]methylene}-4-oxo-2-thioxo-1,3-thiazolidin-3-y l)ethanesulfonic acid
| Molecular Formula | C14H13NO6S3 |
|---|---|
| Molecular Weight | 386.99 g/mol |
| LogP | 1.5622 |
| Topological Polar Surface Area | 100.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.9905 |
| Heavy Atoms | 24 |
| Complexity | 813.41644 |
Chemical Identifiers
| CAS Number | 853903-62-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCS(=O)(=O)O |
Product Overview
F1691-1481 (CAS 853903-62-5), with molecular formula C14H13NO6S3 and molecular weight 386.99 g/mol. IUPAC: 2-[(5Z)-5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid.
Chemical Property Profile of F1691-1481
Property Insights of F1691-1481
The XLogP value of 1.5622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1691-1481. The TPSA of 100.98 Ų falls within the moderate polarity range, balancing permeability and solubility for F1691-1481. Following Lipinski's Rule of Five, F1691-1481 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 F1691-1481?
The CAS number of F1691-1481 is 853903-62-5.
What is the molecular formula of F1691-1481?
The molecular formula of F1691-1481 is C14H13NO6S3.
What is the molecular weight of F1691-1481?
The molecular weight of F1691-1481 is 386.99 g/mol.
Where can I buy F1691-1481?
You can request a quote for F1691-1481 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1691-1481?
Yes, KEHONG BIO provides custom synthesis services for F1691-1481 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.