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1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl- structure
Fine Chemical

1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-

TL;DR: 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl- (CAS 1112-54-5) is a chemical compound with molecular formula C8H13F2N5S and molecular weight 249.08597 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

6-(difluoromethylsulfanyl)-2-N,4-N-diethyl-1,3,5-triazine-2,4-diamine

Also Known As: 1,3,5-Triazine,2-difluoromethio-4,6-bis-ethylami, 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-, 6-[(difluoromethyl)sulfanyl]-n,n'-diethyl-1,3,5-triazine-2,4-diamine, 6-(difluoromethylsulfanyl)-2-N,4-N-diethyl-1,3,5-triazine-2,4-diamine, 6-(difluoromethylsulfanyl)-N,N'-diethyl-1,3,5-triazine-2,4-diamine

CAS Number
1112-54-5
Molecular Formula
C8H13F2N5S
Molecular Weight
249.08597 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Heterocyclic Building Blocks (3 patents)

Technical Specifications

Molecular FormulaC8H13F2N5S
Molecular Weight249.08597 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)88.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors8
Rotatable Bonds6
Exact Mass249.08597 Da
Heavy Atoms16
Complexity183.0
SMILESCCNC1=NC(=NC(=N1)SC(F)F)NCC
InChIKeyDFKDJMGCLPVSIK-UHFFFAOYSA-N

Chemical Property Profile of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-

XLogP
3.3
TPSA (Topological Polar Surface Area)
88.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
8
Rotatable Bonds
6
Heavy Atoms
16
Complexity
183.0
Exact Mass
249.08597
Monoisotopic Mass
249.08597
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 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-

The XLogP value of 3.3 indicates that 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-. Following Lipinski's Rule of Five, 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl- has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-?

The CAS number of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl- is 1112-54-5.

What is the molecular formula of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-?

The molecular formula of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl- is C8H13F2N5S.

What is the molecular weight of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-?

The molecular weight of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl- is 249.08597 g/mol.

Where can I buy 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-?

You can request a quote for 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl-?

Yes, CoreyChem provides custom synthesis services for 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N,N'-diethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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