BAS 00721849
TL;DR: BAS 00721849 (CAS 328068-91-3) is a chemical compound with molecular formula C24H25NO2S3 and molecular weight 455.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-tert-butyl-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-(4-methoxyphenyl)methanone
Also Known As: BAS 00721849, (8-tert-butyl-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-(4-methoxyphenyl)methanone, 8-tert-butyl-5-(4-methoxybenzoyl)-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione, (8-(tert-butyl)-4,4-dimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)(4-methoxyphenyl)methanone, (8-tert-butyl-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(4-methoxyphenyl)methanone
| Molecular Formula | C24H25NO2S3 |
|---|---|
| Molecular Weight | 455.10 g/mol |
| LogP | 7.40769 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 455.10474 |
| Heavy Atoms | 30 |
| Complexity | 1180.3955 |
Chemical Identifiers
| CAS Number | 328068-91-3 |
|---|---|
| SMILES | CC1(C2=C(C3=C(N1C(=O)C4=CC=C(C=C4)OC)C=CC(=C3)C(C)(C)C)C(=S)SS2)C |
Product Overview
BAS 00721849 (CAS 328068-91-3), with molecular formula C24H25NO2S3 and molecular weight 455.10 g/mol. IUPAC: (8-tert-butyl-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-(4-methoxyphenyl)methanone.
Chemical Property Profile of BAS 00721849
Property Insights of BAS 00721849
The XLogP value of 7.40769 indicates that BAS 00721849 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 00721849 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00721849 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00721849?
The CAS number of BAS 00721849 is 328068-91-3.
What is the molecular formula of BAS 00721849?
The molecular formula of BAS 00721849 is C24H25NO2S3.
What is the molecular weight of BAS 00721849?
The molecular weight of BAS 00721849 is 455.10 g/mol.
Where can I buy BAS 00721849?
You can request a quote for BAS 00721849 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00721849?
Yes, KEHONG BIO provides custom synthesis services for BAS 00721849 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.