6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine structure

6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine

TL;DR: 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine (CAS 374548-08-0) is a chemical compound with molecular formula C23H18N8O2S and molecular weight 470.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

6-(1H-benzimidazol-2-ylsulfanyl)-4-N-(4-methylphenyl)-2-N-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine

Also Known As: 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine, 6-(1H-benzimidazol-2-ylsulfanyl)-4-N-(4-methylphenyl)-2-N-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine, 6-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methylphenyl)-N'-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine

CAS: 374548-08-0
Molecular Formula C23H18N8O2S
Molecular Weight 470.13 g/mol
LogP 5.60292
Topological Polar Surface Area 134.55 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 9
Rotatable Bonds 7
Exact Mass 470.12735
Heavy Atoms 34
Complexity 1453.391

Chemical Identifiers

CAS Number 374548-08-0
SMILES CC1=CC=C(C=C1)NC2=NC(=NC(=N2)SC3=NC4=CC=CC=C4N3)NC5=CC(=CC=C5)[N+](=O)[O-]

Product Overview

6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine (CAS 374548-08-0), with molecular formula C23H18N8O2S and molecular weight 470.13 g/mol. IUPAC: 6-(1H-benzimidazol-2-ylsulfanyl)-4-N-(4-methylphenyl)-2-N-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine.

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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 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine

XLogP
5.60292
TPSA (Topological Polar Surface Area)
134.55
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
9
Rotatable Bonds
7
Heavy Atoms
34
Complexity
1453.391
Exact Mass
470.12735
Monoisotopic Mass
470.12735
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 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine

The XLogP value of 5.60292 indicates that 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine. Following Lipinski's Rule of Five, 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine has 3 hydrogen bond donor(s) and 9 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 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine?

The CAS number of 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine is 374548-08-0.

What is the molecular formula of 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine?

The molecular formula of 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine is C23H18N8O2S.

What is the molecular weight of 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine?

The molecular weight of 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine is 470.13 g/mol.

Where can I buy 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine?

You can request a quote for 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine?

Yes, KEHONG BIO provides custom synthesis services for 6-((1H-benzo[d]imidazol-2-yl)thio)-N2-(3-nitrophenyl)-N4-(p-tolyl)-1,3,5-triazine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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