BAS 00757590
TL;DR: BAS 00757590 (CAS 333340-30-0) is a chemical compound with molecular formula C22H24N2O3S2 and molecular weight 428.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-8-ethoxy-4,4-dimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione
Also Known As: BAS 00757590, 2-(3,4-dimethoxyphenyl)-8-ethoxy-4,4-dimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione, 2-(3,4-dimethoxyphenyl)-8-ethoxy-4,4-dimethyl-4,5-dihydroisothiazolo[5,4-c]quinoline-1(2H)-thione, 2-(3,4-Dimethoxy-phenyl)-8-ethoxy-4,4-dimethyl-4,5-dihydro-3-thia-2,5-diaza-cyclopenta[a]naphthalene-1-thione, 2-(3,4-dimethoxyphenyl)-8-ethoxy-4,4-dimethyl-5H-isothiazolo[5,4-c]quinoline-1-thione
| Molecular Formula | C22H24N2O3S2 |
|---|---|
| Molecular Weight | 428.12 g/mol |
| LogP | 6.01179 |
| Topological Polar Surface Area | 44.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.12283 |
| Heavy Atoms | 29 |
| Complexity | 1131.5714 |
Chemical Identifiers
| CAS Number | 333340-30-0 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)NC(C3=C2C(=S)N(S3)C4=CC(=C(C=C4)OC)OC)(C)C |
Product Overview
BAS 00757590 (CAS 333340-30-0), with molecular formula C22H24N2O3S2 and molecular weight 428.12 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-8-ethoxy-4,4-dimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione.
Chemical Property Profile of BAS 00757590
Property Insights of BAS 00757590
The XLogP value of 6.01179 indicates that BAS 00757590 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.65 Ų, BAS 00757590 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00757590 has 1 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 00757590?
The CAS number of BAS 00757590 is 333340-30-0.
What is the molecular formula of BAS 00757590?
The molecular formula of BAS 00757590 is C22H24N2O3S2.
What is the molecular weight of BAS 00757590?
The molecular weight of BAS 00757590 is 428.12 g/mol.
Where can I buy BAS 00757590?
You can request a quote for BAS 00757590 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00757590?
Yes, KEHONG BIO provides custom synthesis services for BAS 00757590 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.