N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine structure

N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine

TL;DR: N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine (CAS 309286-51-9) is a chemical compound with molecular formula C19H23NS2 and molecular weight 329.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-N,N-dimethylaniline

Also Known As: Maybridge1_000847, AB01334974-02, 4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-N,N-dimethylaniline, N1,N1-Dimethyl-4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)aniline, A2136/0089659

CAS: 309286-51-9
Molecular Formula C19H23NS2
Molecular Weight 329.13 g/mol
LogP 5.1
Topological Polar Surface Area 53.8 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 2
Exact Mass 329.1272
Heavy Atoms 22
Complexity 331.0

Chemical Identifiers

CAS Number 309286-51-9
SMILES CC1=CC2=C(CSC(SC2)C3=CC=C(C=C3)N(C)C)C=C1C
InChIKey IWNKLHSWSXTVKF-UHFFFAOYSA-N

Product Overview

N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine (CAS 309286-51-9), with molecular formula C19H23NS2 and molecular weight 329.13 g/mol. IUPAC: 4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-N,N-dimethylaniline.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine

XLogP
5.1
TPSA (Topological Polar Surface Area)
53.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
22
Complexity
331.0
Exact Mass
329.1272
Monoisotopic Mass
329.1272
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-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine

The XLogP value of 5.1 indicates that N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.8 Ų, N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine?

The CAS number of N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine is 309286-51-9.

What is the molecular formula of N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine?

The molecular formula of N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine is C19H23NS2.

What is the molecular weight of N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine?

The molecular weight of N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine is 329.13 g/mol.

Where can I buy N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine?

You can request a quote for N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine?

Yes, KEHONG BIO provides custom synthesis services for N-[4-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenyl]-N,N-dimethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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