BAS 00721869
TL;DR: BAS 00721869 (CAS 5675-19-4) is a chemical compound with molecular formula C24H23NO3S3 and molecular weight 469.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3,4-dimethoxyphenyl)-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)prop-2-en-1-one
Also Known As: BAS 00721869, (E)-3-(3,4-dimethoxyphenyl)-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)prop-2-en-1-one, (2E)-3-(3,4-dimethoxyphenyl)-1-(4,4,8-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)prop-2-en-1-one, (2E)-3-(3,4-dimethoxyphenyl)-1-(4,4,8-trimethyl-1-thioxo(4,5-dihydro-1,2-dithi oleno[5,4-c]quinolin-5-yl))prop-2-en-1-one, (E)-3-(3,4-dimethoxyphenyl)-1-(4,4,8-trimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)prop-2-en-1-one
| Molecular Formula | C24H23NO3S3 |
|---|---|
| Molecular Weight | 469.08 g/mol |
| LogP | 6.82681 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 469.084 |
| Heavy Atoms | 31 |
| Complexity | 1253.1957 |
Chemical Identifiers
| CAS Number | 5675-19-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)C(=O)/C=C/C4=CC(=C(C=C4)OC)OC |
Product Overview
BAS 00721869 (CAS 5675-19-4), with molecular formula C24H23NO3S3 and molecular weight 469.08 g/mol. IUPAC: (E)-3-(3,4-dimethoxyphenyl)-1-(4,4,8-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)prop-2-en-1-one.
Chemical Property Profile of BAS 00721869
Property Insights of BAS 00721869
The XLogP value of 6.82681 indicates that BAS 00721869 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, BAS 00721869 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00721869 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 00721869?
The CAS number of BAS 00721869 is 5675-19-4.
What is the molecular formula of BAS 00721869?
The molecular formula of BAS 00721869 is C24H23NO3S3.
What is the molecular weight of BAS 00721869?
The molecular weight of BAS 00721869 is 469.08 g/mol.
Where can I buy BAS 00721869?
You can request a quote for BAS 00721869 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00721869?
Yes, KEHONG BIO provides custom synthesis services for BAS 00721869 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.