F1691-1494
TL;DR: F1691-1494 (CAS 868147-60-8) is a chemical compound with molecular formula C20H16N2O4S2 and molecular weight 412.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(Z)-[3-(4-acetamidophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate
Also Known As: F1691-1494, METHYL 4-{[(5Z)-3-(4-ACETAMIDOPHENYL)-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-5-YLIDENE]METHYL}BENZOATE, (Z)-methyl 4-((3-(4-acetamidophenyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)benzoate, methyl 4-[(Z)-[3-(4-acetamidophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate, methyl 4-({3-[4-(acetylamino)phenyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene} methyl)benzoate
| Molecular Formula | C20H16N2O4S2 |
|---|---|
| Molecular Weight | 412.06 g/mol |
| LogP | 3.8374 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.05515 |
| Heavy Atoms | 28 |
| Complexity | 982.2702 |
Chemical Identifiers
| CAS Number | 868147-60-8 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(C=C3)C(=O)OC)/SC2=S |
Product Overview
F1691-1494 (CAS 868147-60-8), with molecular formula C20H16N2O4S2 and molecular weight 412.06 g/mol. IUPAC: methyl 4-[(Z)-[3-(4-acetamidophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate.
Chemical Property Profile of F1691-1494
Property Insights of F1691-1494
The XLogP value of 3.8374 indicates that F1691-1494 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for F1691-1494. Following Lipinski's Rule of Five, F1691-1494 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 F1691-1494?
The CAS number of F1691-1494 is 868147-60-8.
What is the molecular formula of F1691-1494?
The molecular formula of F1691-1494 is C20H16N2O4S2.
What is the molecular weight of F1691-1494?
The molecular weight of F1691-1494 is 412.06 g/mol.
Where can I buy F1691-1494?
You can request a quote for F1691-1494 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1691-1494?
Yes, KEHONG BIO provides custom synthesis services for F1691-1494 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.