3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea structure

3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea

TL;DR: 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea (CAS 438031-40-4) is a chemical compound with molecular formula C15H22N8S and molecular weight 346.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

1-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]amino]-3-(4-methylphenyl)thiourea

Also Known As: F2703-0031, 3-{[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea, 1-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]amino]-3-(4-methylphenyl)thiourea, 2,4-bis(ethylamino)-6-[4-(p-tolyl)thiosemicarbazido]-1,3,5-triazine, 2-(4,6-bis(ethylamino)-1,3,5-triazin-2-yl)-N-(p-tolyl)hydrazine-1-carbothioamide

CAS: 438031-40-4
Molecular Formula C15H22N8S
Molecular Weight 346.17 g/mol
LogP 2.35712
Topological Polar Surface Area 98.82 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 346.16882
Heavy Atoms 24
Complexity 649.4243

Chemical Identifiers

CAS Number 438031-40-4
SMILES CCNC1=NC(=NC(=N1)NNC(=S)NC2=CC=C(C=C2)C)NCC

Product Overview

3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea (CAS 438031-40-4), with molecular formula C15H22N8S and molecular weight 346.17 g/mol. IUPAC: 1-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]amino]-3-(4-methylphenyl)thiourea.

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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 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea

XLogP
2.35712
TPSA (Topological Polar Surface Area)
98.82
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
7
Rotatable Bonds
7
Heavy Atoms
24
Complexity
649.4243
Exact Mass
346.16882
Monoisotopic Mass
346.16882
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 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea

The XLogP value of 2.35712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea. The TPSA of 98.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea. Following Lipinski's Rule of Five, 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

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 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea?

The CAS number of 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea is 438031-40-4.

What is the molecular formula of 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea?

The molecular formula of 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea is C15H22N8S.

What is the molecular weight of 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea?

The molecular weight of 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea is 346.17 g/mol.

Where can I buy 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea?

You can request a quote for 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea?

Yes, KEHONG BIO provides custom synthesis services for 3-{[4,6-Bis(ethylamino)-1,3,5-triazin-2-yl]amino}-1-(4-methylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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