BAS 00802024
TL;DR: BAS 00802024 (CAS 332019-56-4) is a chemical compound with molecular formula C17H16N4OS4 and molecular weight 420.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)ethanone
Also Known As: BAS 00802024, AB00094353-01, 2-((4H-1,2,4-triazol-3-yl)thio)-1-(4,4,8-trimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)ethanone, 2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)ethanone, 2-(4H-1,2,4-triazol-3-ylsulfanyl)-1-(4,4,8-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethanone
| Molecular Formula | C17H16N4OS4 |
|---|---|
| Molecular Weight | 420.02 g/mol |
| LogP | 5.00661 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.0207 |
| Heavy Atoms | 26 |
| Complexity | 1035.4678 |
Chemical Identifiers
| CAS Number | 332019-56-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)C(=O)CSC4=NC=NN4 |
Product Overview
BAS 00802024 (CAS 332019-56-4), with molecular formula C17H16N4OS4 and molecular weight 420.02 g/mol. IUPAC: 2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)ethanone.
Chemical Property Profile of BAS 00802024
Property Insights of BAS 00802024
The XLogP value of 5.00661 indicates that BAS 00802024 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00802024. Following Lipinski's Rule of Five, BAS 00802024 has 1 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 00802024?
The CAS number of BAS 00802024 is 332019-56-4.
What is the molecular formula of BAS 00802024?
The molecular formula of BAS 00802024 is C17H16N4OS4.
What is the molecular weight of BAS 00802024?
The molecular weight of BAS 00802024 is 420.02 g/mol.
Where can I buy BAS 00802024?
You can request a quote for BAS 00802024 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00802024?
Yes, KEHONG BIO provides custom synthesis services for BAS 00802024 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.