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Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl- structure
Fine Chemical

Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-

TL;DR: Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl- (CAS 103428-03-1) is a chemical compound with molecular formula C11H16F2N6S and molecular weight 302.11252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[[4-(difluoromethylsulfanyl)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropanenitrile

Also Known As: Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-, 2-({4-[(difluoromethyl)sulfanyl]-6-(propan-2-ylamino)-1,3,5-triazin-2-yl}amino)-2-methylpropanenitrile, 2-[[4-(difluoromethylsulfanyl)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropanenitrile, Propanenitrile,2-[[4-[(difluoromethyl)thio]-6-[(1-methylethyl)amino]-1,3,5-triazin-2-yl]amino]-2-methyl-, 6-[(difluoromethyl)sulfanyl]-N2,N4-di(propan-2-yl)-1,3,5-triazine-2,4-diamine

CAS Number
103428-03-1
Molecular Formula
C11H16F2N6S
Molecular Weight
302.11252 g/mol
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Technical Specifications

Molecular FormulaC11H16F2N6S
Molecular Weight302.11252 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)112.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors9
Rotatable Bonds6
Exact Mass302.11252 Da
Heavy Atoms20
Complexity356.0
SMILESCC(C)NC1=NC(=NC(=N1)SC(F)F)NC(C)(C)C#N
InChIKeyVSCAFCMIGPTJLQ-UHFFFAOYSA-N

Chemical Property Profile of Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-

XLogP
3.6
TPSA (Topological Polar Surface Area)
112.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
9
Rotatable Bonds
6
Heavy Atoms
20
Complexity
356.0
Exact Mass
302.11252
Monoisotopic Mass
302.11252
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 Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-

The XLogP value of 3.6 indicates that Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-. Following Lipinski's Rule of Five, Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl- has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-?

The CAS number of Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl- is 103428-03-1.

What is the molecular formula of Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-?

The molecular formula of Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl- is C11H16F2N6S.

What is the molecular weight of Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-?

The molecular weight of Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl- is 302.11252 g/mol.

Where can I buy Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-?

You can request a quote for Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl-?

Yes, CoreyChem provides custom synthesis services for Propanenitrile, 2-((4-((difluoromethyl)thio)-6-((1-methylethyl)amino)-1,3,5-triazin-2-yl)amino)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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