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Thenyldiamine structure
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Thenyldiamine

TL;DR: Thenyldiamine (CAS 91-79-2) is a chemical compound with molecular formula C14H19N3S and molecular weight 261.12997 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N,N-dimethyl-N'-pyridin-2-yl-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine

Also Known As: THENYLDIAMINE, Tenfidil, Thenfadil, Thefanil, Dethylandiamine

CAS Number
91-79-2
Molecular Formula
C14H19N3S
Molecular Weight
261.12997 g/mol
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Application Areas

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

Agrochemicals (1 patents) Analytical Reagents (1 patents) Heterocyclic Building Blocks (7 patents) Pharmaceutical Intermediates (142 patents) Polymer Intermediates (2 patents)

Technical Specifications

Molecular FormulaC14H19N3S
Molecular Weight261.12997 g/mol
XLogP3.0
Topological Polar Surface Area (TPSA)47.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass261.12997 Da
Heavy Atoms18
Complexity235.0
Boiling Point169-172 °C @ 1.0 MM HG
Refractive IndexINDEX OF REFRACTION: 1.5915 @ 20 °C/D
SMILESCN(C)CCN(CC1=CSC=C1)C2=CC=CC=N2
InChIKeyRCGYDFVCAAKKNG-UHFFFAOYSA-N

Product Description

Applications: Thenyldiamine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A pharmaceutical intermediate supplied by CoreyChem, Thenyldiamine (CAS 91-79-2) has the molecular formula C14H19N3S and a molecular weight of 261.13 g/mol. Synonyms include THENYLDIAMINE and Tenfidil.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Thenyldiamine

XLogP
3.0
TPSA (Topological Polar Surface Area)
47.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
18
Complexity
235.0
Exact Mass
261.12997
Monoisotopic Mass
261.12997
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 Thenyldiamine

The XLogP value of 3.0 indicates that Thenyldiamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, Thenyldiamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thenyldiamine has 0 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 Thenyldiamine?

The CAS number of Thenyldiamine is 91-79-2.

What is the molecular formula of Thenyldiamine?

The molecular formula of Thenyldiamine is C14H19N3S.

What is the molecular weight of Thenyldiamine?

The molecular weight of Thenyldiamine is 261.12997 g/mol.

What are the applications of Thenyldiamine?

Thenyldiamine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy Thenyldiamine?

You can request a quote for Thenyldiamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Thenyldiamine?

Yes, CoreyChem provides custom synthesis services for Thenyldiamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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