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N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine structure
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N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine

TL;DR: N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine (CAS 139009-17-9) is a chemical compound with molecular formula C15H16BrNS and molecular weight 321.01868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[2-(2-bromophenyl)sulfanylphenyl]-N,N-dimethylmethanamine

Also Known As: N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine, AE-641/00359039, 1-[2-(2-bromophenyl)sulfanylphenyl]-N,N-dimethylmethanamine

CAS Number
139009-17-9
Molecular Formula
C15H16BrNS
Molecular Weight
321.01868 g/mol
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Technical Specifications

Molecular FormulaC15H16BrNS
Molecular Weight321.01868 g/mol
XLogP4.5
Topological Polar Surface Area (TPSA)28.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds4
Exact Mass321.01868 Da
Heavy Atoms18
Complexity247.0
SMILESCN(C)CC1=CC=CC=C1SC2=CC=CC=C2Br
InChIKeyIPHZDYNMAHVCMZ-UHFFFAOYSA-N

Chemical Property Profile of N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine

XLogP
4.5
TPSA (Topological Polar Surface Area)
28.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
4
Heavy Atoms
18
Complexity
247.0
Exact Mass
321.01868
Monoisotopic Mass
321.01868
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 N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine

The XLogP value of 4.5 indicates that N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine?

The CAS number of N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine is 139009-17-9.

What is the molecular formula of N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine?

The molecular formula of N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine is C15H16BrNS.

What is the molecular weight of N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine?

The molecular weight of N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine is 321.01868 g/mol.

Where can I buy N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine?

You can request a quote for N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine?

Yes, CoreyChem provides custom synthesis services for N-{2-[(2-bromophenyl)sulfanyl]benzyl}-N,N-dimethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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