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4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione structure
Fine Chemical

4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione

TL;DR: 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione (CAS 161370-60-1) is a chemical compound with molecular formula C13H13NS3 and molecular weight 279.02103 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4,4,8-trimethyl-5H-dithiolo[3,4-c]quinoline-1-thione

Also Known As: 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione, ZERO/005059, BAS 00096152, 4,4,8-trimethyl-5H-dithiolo[3,4-c]quinoline-1-thione, J1.842.406A

CAS Number
161370-60-1
Molecular Formula
C13H13NS3
Molecular Weight
279.02103 g/mol
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Technical Specifications

Molecular FormulaC13H13NS3
Molecular Weight279.02103 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)94.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds0
Exact Mass279.02103 Da
Heavy Atoms17
Complexity399.0
SMILESCC1=CC2=C(C=C1)NC(C3=C2C(=S)SS3)(C)C
InChIKeyFQQSYGBRPKTQGF-UHFFFAOYSA-N

Chemical Property Profile of 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione

XLogP
3.3
TPSA (Topological Polar Surface Area)
94.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
0
Heavy Atoms
17
Complexity
399.0
Exact Mass
279.02103
Monoisotopic Mass
279.02103
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione

The XLogP value of 3.3 indicates that 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione. Following Lipinski's Rule of Five, 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione?

The CAS number of 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione is 161370-60-1.

What is the molecular formula of 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione?

The molecular formula of 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione is C13H13NS3.

What is the molecular weight of 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione?

The molecular weight of 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione is 279.02103 g/mol.

Where can I buy 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione?

You can request a quote for 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione?

Yes, CoreyChem provides custom synthesis services for 4,4,8-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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