(4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate
TL;DR: (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate (CAS 30360-06-6) is a chemical compound with molecular formula C16H12N6S and molecular weight 320.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,6-dianilino-1,3,5-triazin-2-yl) thiocyanate
Also Known As: (4,6-dianilino-1,3,5-triazin-2-yl) thiocyanate, J1.615.762G, 4,6-Dianilino-1,3,5-triazin-2-yl thiocyanate, 4,6-DIANILINO-S-TRIAZIN-2-YL THIOCYANATE, Thiocyanic acid 4,6-bis(phenylamino)-s-triazine-2-yl ester
| Molecular Formula | C16H12N6S |
|---|---|
| Molecular Weight | 320.08 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.0844 |
| Heavy Atoms | 23 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 30360-06-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=NC(=NC(=N2)SC#N)NC3=CC=CC=C3 |
| InChIKey | VJDKTESUIIBCDG-UHFFFAOYSA-N |
Product Overview
(4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate (CAS 30360-06-6), with molecular formula C16H12N6S and molecular weight 320.08 g/mol. IUPAC: (4,6-dianilino-1,3,5-triazin-2-yl) thiocyanate.
Chemical Property Profile of (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate
Property Insights of (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate
The XLogP value of 4.6 indicates that (4,6-Dianilino-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-Dianilino-1,3,5-triazin-2-yl) thiocyanate. Following Lipinski's Rule of Five, (4,6-Dianilino-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-Dianilino-1,3,5-triazin-2-yl) thiocyanate?
The CAS number of (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate is 30360-06-6.
What is the molecular formula of (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate?
The molecular formula of (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate is C16H12N6S.
What is the molecular weight of (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate?
The molecular weight of (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate is 320.08 g/mol.
Where can I buy (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate?
You can request a quote for (4,6-Dianilino-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-Dianilino-1,3,5-triazin-2-yl) thiocyanate?
Yes, KEHONG BIO provides custom synthesis services for (4,6-Dianilino-1,3,5-triazin-2-yl) thiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.