CCF642
TL;DR: CCF642 (CAS 346640-08-2) is a chemical compound with molecular formula C15H10N2O4S3 and molecular weight 377.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(4-methoxyphenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: CCF642, s8281, 3-(4-Methoxyphenyl)-5-[(5-nitro-2-thienyl)methylene]-2-thioxo-4-thiazolidinone, (5Z)-3-(4-methoxyphenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-3-(4-methoxyphenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C15H10N2O4S3 |
|---|---|
| Molecular Weight | 377.98 g/mol |
| LogP | 4.0707 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.98026 |
| Heavy Atoms | 24 |
| Complexity | 857.8591 |
Chemical Identifiers
| CAS Number | 346640-08-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(S3)[N+](=O)[O-])/SC2=S |
Product Overview
CCF642 (CAS 346640-08-2), with molecular formula C15H10N2O4S3 and molecular weight 377.98 g/mol. IUPAC: (5Z)-3-(4-methoxyphenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of CCF642
Property Insights of CCF642
The XLogP value of 4.0707 indicates that CCF642 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for CCF642. Following Lipinski's Rule of Five, CCF642 has 0 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 CCF642?
The CAS number of CCF642 is 346640-08-2.
What is the molecular formula of CCF642?
The molecular formula of CCF642 is C15H10N2O4S3.
What is the molecular weight of CCF642?
The molecular weight of CCF642 is 377.98 g/mol.
Where can I buy CCF642?
You can request a quote for CCF642 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CCF642?
Yes, KEHONG BIO provides custom synthesis services for CCF642 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.