BAS 00385458
TL;DR: BAS 00385458 (CAS 327167-80-6) is a chemical compound with molecular formula C26H21NO2S3 and molecular weight 475.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-(2-phenylphenyl)methanone
Also Known As: BAS 00385458, (8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-(2-phenylphenyl)methanone, 5-([1,1'-biphenyl]-2-ylcarbonyl)-8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione, [1,1'-biphenyl]-2-yl(8-methoxy-4,4-dimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)methanone, biphenyl-2-yl(8-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone
| Molecular Formula | C26H21NO2S3 |
|---|---|
| Molecular Weight | 475.07 g/mol |
| LogP | 7.77719 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 475.07346 |
| Heavy Atoms | 32 |
| Complexity | 1385.7098 |
Chemical Identifiers
| CAS Number | 327167-80-6 |
|---|---|
| SMILES | CC1(C2=C(C3=C(N1C(=O)C4=CC=CC=C4C5=CC=CC=C5)C=CC(=C3)OC)C(=S)SS2)C |
Product Overview
BAS 00385458 (CAS 327167-80-6), with molecular formula C26H21NO2S3 and molecular weight 475.07 g/mol. IUPAC: (8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-(2-phenylphenyl)methanone.
Chemical Property Profile of BAS 00385458
Property Insights of BAS 00385458
The XLogP value of 7.77719 indicates that BAS 00385458 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, BAS 00385458 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00385458 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00385458?
The CAS number of BAS 00385458 is 327167-80-6.
What is the molecular formula of BAS 00385458?
The molecular formula of BAS 00385458 is C26H21NO2S3.
What is the molecular weight of BAS 00385458?
The molecular weight of BAS 00385458 is 475.07 g/mol.
Where can I buy BAS 00385458?
You can request a quote for BAS 00385458 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00385458?
Yes, KEHONG BIO provides custom synthesis services for BAS 00385458 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.