BAS 00351277
TL;DR: BAS 00351277 (CAS 331254-79-6) is a chemical compound with molecular formula C15H12F3NOS3 and molecular weight 375.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-1-(4,4,7-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)ethanone
Also Known As: BAS 00351277, 2,2,2-trifluoro-1-(4,4,7-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)ethanone, 2,2,2-trifluoro-1-(4,4,7-trimethyl-1-thioxo(4,5-dihydro-1,2-dithioleno[5,4-c]q uinolin-5-yl))ethan-1-one, 2,2,2-trifluoro-1-(4,4,7-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethanone, 2,2,2-trifluoro-1-(4,4,7-trimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)ethanone
| Molecular Formula | C15H12F3NOS3 |
|---|---|
| Molecular Weight | 375.00 g/mol |
| LogP | 5.65851 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 375.00333 |
| Heavy Atoms | 23 |
| Complexity | 863.5825 |
Chemical Identifiers
| CAS Number | 331254-79-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C3=C(C(N2C(=O)C(F)(F)F)(C)C)SSC3=S |
Product Overview
BAS 00351277 (CAS 331254-79-6), with molecular formula C15H12F3NOS3 and molecular weight 375.00 g/mol. IUPAC: 2,2,2-trifluoro-1-(4,4,7-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)ethanone.
Chemical Property Profile of BAS 00351277
Property Insights of BAS 00351277
The XLogP value of 5.65851 indicates that BAS 00351277 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, BAS 00351277 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00351277 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00351277?
The CAS number of BAS 00351277 is 331254-79-6.
What is the molecular formula of BAS 00351277?
The molecular formula of BAS 00351277 is C15H12F3NOS3.
What is the molecular weight of BAS 00351277?
The molecular weight of BAS 00351277 is 375.00 g/mol.
Where can I buy BAS 00351277?
You can request a quote for BAS 00351277 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00351277?
Yes, KEHONG BIO provides custom synthesis services for BAS 00351277 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.