BAS 00416459
TL;DR: BAS 00416459 (CAS 306326-34-1) is a chemical compound with molecular formula C21H22N2OS2 and molecular weight 382.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-ethylphenyl)-8-methoxy-4,4-dimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione
Also Known As: BAS 00416459, 2-(4-ethylphenyl)-8-methoxy-4,4-dimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione, 2-(4-ethylphenyl)-8-methoxy-4,4-dimethyl-4,5-dihydroisothiazolo[5,4-c]quinoline-1(2H)-thione, 2-(4-ethylphenyl)-8-methoxy-4,4-dimethyl-2,4,5-trihydroisothiazolo[5,4-c]quino line-1-thione, 2-(4-ethylphenyl)-8-methoxy-4,4-dimethyl-4,5-dihydro[1,2]thiazolo[5,4-c]quinoline-1(2H)-thione
| Molecular Formula | C21H22N2OS2 |
|---|---|
| Molecular Weight | 382.12 g/mol |
| LogP | 6.16689 |
| Topological Polar Surface Area | 26.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.11737 |
| Heavy Atoms | 26 |
| Complexity | 1029.1549 |
Chemical Identifiers
| CAS Number | 306326-34-1 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N2C(=S)C3=C(S2)C(NC4=C3C=C(C=C4)OC)(C)C |
Product Overview
BAS 00416459 (CAS 306326-34-1), with molecular formula C21H22N2OS2 and molecular weight 382.12 g/mol. IUPAC: 2-(4-ethylphenyl)-8-methoxy-4,4-dimethyl-5H-[1,2]thiazolo[5,4-c]quinoline-1-thione.
Chemical Property Profile of BAS 00416459
Property Insights of BAS 00416459
The XLogP value of 6.16689 indicates that BAS 00416459 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.19 Ų, BAS 00416459 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00416459 has 1 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 00416459?
The CAS number of BAS 00416459 is 306326-34-1.
What is the molecular formula of BAS 00416459?
The molecular formula of BAS 00416459 is C21H22N2OS2.
What is the molecular weight of BAS 00416459?
The molecular weight of BAS 00416459 is 382.12 g/mol.
Where can I buy BAS 00416459?
You can request a quote for BAS 00416459 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00416459?
Yes, KEHONG BIO provides custom synthesis services for BAS 00416459 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.