[4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate
TL;DR: [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate (CAS 30360-05-5) is a chemical compound with molecular formula C10H12N6S and molecular weight 248.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,6-bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate
Also Known As: [4,6-bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate|J1.615.761I|4,6-BIS(ALLYLAMINO)-S-TRIAZIN-2-YL THIOCYANATE|Thiocyanic acid 4,6-bis(allylamino)-s-triazine-2-yl ester|4,6-Bis[(prop-2-en-1-yl)amino]-1,3,5-triazin-2-yl thiocyanate|({4,6-bis[(prop-2-en-1-yl)amino]-1,3,5-triazin-2-yl}sulfanyl)formonitrile
| Molecular Formula | C10H12N6S |
|---|---|
| Molecular Weight | 248.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 248.08441 |
| Heavy Atoms | 17 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 30360-05-5 |
|---|---|
| SMILES | C=CCNC1=NC(=NC(=N1)SC#N)NCC=C |
| InChIKey | AWJVXYOCUCVYGG-UHFFFAOYSA-N |
Product Overview
[4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate (CAS 30360-05-5), with molecular formula C10H12N6S and molecular weight 248.08 g/mol. IUPAC: [4,6-bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate.
Chemical Property Profile of [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate
Property Insights of [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate. Following Lipinski's Rule of Five, [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate?
The CAS number of [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate is 30360-05-5.
What is the molecular formula of [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate?
The molecular formula of [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate is C10H12N6S.
What is the molecular weight of [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate?
The molecular weight of [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate is 248.08 g/mol.
Where can I buy [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate?
You can request a quote for [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate?
Yes, KEHONG BIO provides custom synthesis services for [4,6-Bis(prop-2-enylamino)-1,3,5-triazin-2-yl] thiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.