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

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

TL;DR: 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- (CAS 111422-31-2) is a chemical compound with molecular formula C12H21F2N5S and molecular weight 305.14856 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

6-(difluoromethylsulfanyl)-4-N-pentyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine

Also Known As: 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl-, 6-[(difluoromethyl)sulfanyl]-n-pentyl-n'-(propan-2-yl)-1,3,5-triazine-2,4-diamine, 6-(difluoromethylsulfanyl)-4-N-pentyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine, 6-(difluoromethylsulfanyl)-N'-pentyl-N-propan-2-yl-1,3,5-triazine-2,4-diamine, 6-[(Difluoromethyl)sulfanyl]-N~4~-pentyl-N~2~-(propan-2-yl)-1,3,5-triazine-2,4(1H,3H)-diimine

CAS Number
111422-31-2
Molecular Formula
C12H21F2N5S
Molecular Weight
305.14856 g/mol
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Technical Specifications

Molecular FormulaC12H21F2N5S
Molecular Weight305.14856 g/mol
XLogP5.2
Topological Polar Surface Area (TPSA)88.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors8
Rotatable Bonds9
Exact Mass305.14856 Da
Heavy Atoms20
Complexity258.0
SMILESCCCCCNC1=NC(=NC(=N1)SC(F)F)NC(C)C
InChIKeyVFLVYPNSSZKAJP-UHFFFAOYSA-N

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

XLogP
5.2
TPSA (Topological Polar Surface Area)
88.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
8
Rotatable Bonds
9
Heavy Atoms
20
Complexity
258.0
Exact Mass
305.14856
Monoisotopic Mass
305.14856
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-(1-methylethyl)-N'-pentyl-

The XLogP value of 5.2 indicates that 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- 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-(1-methylethyl)-N'-pentyl-. Following Lipinski's Rule of Five, 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

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

The CAS number of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- is 111422-31-2.

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

The molecular formula of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- is C12H21F2N5S.

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

The molecular weight of 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- is 305.14856 g/mol.

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

You can request a quote for 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1-methylethyl)-N'-pentyl- 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-(1-methylethyl)-N'-pentyl-?

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

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