BAS 00315532
TL;DR: BAS 00315532 (CAS 309738-29-2) is a chemical compound with molecular formula C21H21NO3S4 and molecular weight 463.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-ethoxy-4,4-dimethyl-5-(4-methylphenyl)sulfonyldithiolo[3,4-c]quinoline-1-thione
Also Known As: BAS 00315532, A2194/0092289, 8-ethoxy-4,4-dimethyl-5-[(4-methylphenyl)sulfonyl]-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione, 8-ethoxy-4,4-dimethyl-5-(4-methylphenyl)sulfonyldithiolo[3,4-c]quinoline-1-thione, 8-ethoxy-4,4-dimethyl-5-tosyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione
| Molecular Formula | C21H21NO3S4 |
|---|---|
| Molecular Weight | 463.04 g/mol |
| LogP | 6.35721 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 463.04044 |
| Heavy Atoms | 29 |
| Complexity | 1237.6758 |
Chemical Identifiers
| CAS Number | 309738-29-2 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)S(=O)(=O)C4=CC=C(C=C4)C |
Product Overview
BAS 00315532 (CAS 309738-29-2), with molecular formula C21H21NO3S4 and molecular weight 463.04 g/mol. IUPAC: 8-ethoxy-4,4-dimethyl-5-(4-methylphenyl)sulfonyldithiolo[3,4-c]quinoline-1-thione.
Chemical Property Profile of BAS 00315532
Property Insights of BAS 00315532
The XLogP value of 6.35721 indicates that BAS 00315532 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, BAS 00315532 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00315532 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 00315532?
The CAS number of BAS 00315532 is 309738-29-2.
What is the molecular formula of BAS 00315532?
The molecular formula of BAS 00315532 is C21H21NO3S4.
What is the molecular weight of BAS 00315532?
The molecular weight of BAS 00315532 is 463.04 g/mol.
Where can I buy BAS 00315532?
You can request a quote for BAS 00315532 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00315532?
Yes, KEHONG BIO provides custom synthesis services for BAS 00315532 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.