BAS 02232773
TL;DR: BAS 02232773 (CAS 374091-13-1) is a chemical compound with molecular formula C17H16N2O2S4 and molecular weight 408.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(8-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl] thiocyanate
Also Known As: BAS 02232773, 2-(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl thiocyanate, [2-(8-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl] thiocyanate, [2-(8-ethoxy-4,4-dimethyl-1-thioxo(4,5-dihydro-1,2-dithioleno[5,4-c]quinolin-5 -yl))-2-oxoethyl]thiocarbonitrile, 1-(8-ethoxy-4,4-dimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)-2-thiocyanatoethanone
| Molecular Formula | C17H16N2O2S4 |
|---|---|
| Molecular Weight | 408.01 g/mol |
| LogP | 5.40077 |
| Topological Polar Surface Area | 53.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.00946 |
| Heavy Atoms | 25 |
| Complexity | 923.45953 |
Chemical Identifiers
| CAS Number | 374091-13-1 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)C(=O)CSC#N |
Product Overview
BAS 02232773 (CAS 374091-13-1), with molecular formula C17H16N2O2S4 and molecular weight 408.01 g/mol. IUPAC: [2-(8-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl] thiocyanate.
Chemical Property Profile of BAS 02232773
Property Insights of BAS 02232773
The XLogP value of 5.40077 indicates that BAS 02232773 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.33 Ų, BAS 02232773 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02232773 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02232773?
The CAS number of BAS 02232773 is 374091-13-1.
What is the molecular formula of BAS 02232773?
The molecular formula of BAS 02232773 is C17H16N2O2S4.
What is the molecular weight of BAS 02232773?
The molecular weight of BAS 02232773 is 408.01 g/mol.
Where can I buy BAS 02232773?
You can request a quote for BAS 02232773 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02232773?
Yes, KEHONG BIO provides custom synthesis services for BAS 02232773 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.