![3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one structure](/static/products/372/372184-13-9.png)
3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one
TL;DR: 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one (CAS 372184-13-9) is a chemical compound with molecular formula C18H20N2O3S3 and molecular weight 408.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one
Also Known As: 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one, 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one, 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)butan-1-one
| Molecular Formula | C18H20N2O3S3 |
|---|---|
| Molecular Weight | 408.06 g/mol |
| LogP | 6.05051 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.0636 |
| Heavy Atoms | 26 |
| Complexity | 972.5463 |
Chemical Identifiers
| CAS Number | 372184-13-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1[N+](=O)[O-])C3=C(C(N2C(=O)CC(C)C)(C)C)SSC3=S |
Product Overview
3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one (CAS 372184-13-9), with molecular formula C18H20N2O3S3 and molecular weight 408.06 g/mol. IUPAC: 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one.
Chemical Property Profile of 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one
Property Insights of 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one
The XLogP value of 6.05051 indicates that 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one. Following Lipinski's Rule of Five, 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one 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 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one?
The CAS number of 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one is 372184-13-9.
What is the molecular formula of 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one?
The molecular formula of 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one is C18H20N2O3S3.
What is the molecular weight of 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one?
The molecular weight of 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one is 408.06 g/mol.
Where can I buy 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one?
You can request a quote for 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-1-(4,4,7-trimethyl-8-nitro-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)butan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.