BAS 00108071
TL;DR: BAS 00108071 (CAS 300802-04-4) is a chemical compound with molecular formula C18H15NO2S4 and molecular weight 405.00 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)-thiophen-2-ylmethanone
Also Known As: BAS 00108071, 8-methoxy-4,4-dimethyl-5-(2-thienylcarbonyl)-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione, (8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-thiophen-2-ylmethanone, (8-Methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-2,3-dithia-5-aza-cyclopenta[a]naphthalen-5-yl)-thiophen-2-yl-methanone, (8-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(2-thienyl)methanone
| Molecular Formula | C18H15NO2S4 |
|---|---|
| Molecular Weight | 405.00 g/mol |
| LogP | 6.17169 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 404.99857 |
| Heavy Atoms | 25 |
| Complexity | 1014.1281 |
Chemical Identifiers
| CAS Number | 300802-04-4 |
|---|---|
| SMILES | CC1(C2=C(C3=C(N1C(=O)C4=CC=CS4)C=CC(=C3)OC)C(=S)SS2)C |
Product Overview
BAS 00108071 (CAS 300802-04-4), with molecular formula C18H15NO2S4 and molecular weight 405.00 g/mol. IUPAC: (8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-thiophen-2-ylmethanone.
Chemical Property Profile of BAS 00108071
Property Insights of BAS 00108071
The XLogP value of 6.17169 indicates that BAS 00108071 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 00108071 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00108071 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00108071?
The CAS number of BAS 00108071 is 300802-04-4.
What is the molecular formula of BAS 00108071?
The molecular formula of BAS 00108071 is C18H15NO2S4.
What is the molecular weight of BAS 00108071?
The molecular weight of BAS 00108071 is 405.00 g/mol.
Where can I buy BAS 00108071?
You can request a quote for BAS 00108071 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00108071?
Yes, KEHONG BIO provides custom synthesis services for BAS 00108071 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.