[4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate
TL;DR: [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate (CAS 30360-92-0) is a chemical compound with molecular formula C10H16N6S and molecular weight 252.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate
Also Known As: [4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate|J1.613.468F|THIOCYANIC ACID, 4,6-BIS(ISOPROPYLAMINO)-S-TRI*|4,6-Bis[(propan-2-yl)amino]-1,3,5-triazin-2-yl thiocyanate|Thiocyanic acid 4,6-bis(isopropylamino)-s-triazine-2-yl ester|({4,6-bis[(propan-2-yl)amino]-1,3,5-triazin-2-yl}sulfanyl)formonitrile|Thiocyanic acid,4,6-bis[(1-methylethyl)amino]-1,3,5-triazin-2-yl ester
| Molecular Formula | C10H16N6S |
|---|---|
| Molecular Weight | 252.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.11572 |
| Heavy Atoms | 17 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 30360-92-0 |
|---|---|
| SMILES | CC(C)NC1=NC(=NC(=N1)SC#N)NC(C)C |
| InChIKey | MQDHUALOAYVISZ-UHFFFAOYSA-N |
Product Overview
[4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate (CAS 30360-92-0), with molecular formula C10H16N6S and molecular weight 252.12 g/mol. IUPAC: [4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate.
Chemical Property Profile of [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate
Property Insights of [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate
The XLogP value of 3.6 indicates that [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate. Following Lipinski's Rule of Five, [4,6-Bis(propan-2-ylamino)-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(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate?
The CAS number of [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate is 30360-92-0.
What is the molecular formula of [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate?
The molecular formula of [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate is C10H16N6S.
What is the molecular weight of [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate?
The molecular weight of [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate is 252.12 g/mol.
Where can I buy [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate?
You can request a quote for [4,6-Bis(propan-2-ylamino)-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(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate?
Yes, KEHONG BIO provides custom synthesis services for [4,6-Bis(propan-2-ylamino)-1,3,5-triazin-2-yl] thiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.