N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine
TL;DR: N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine (CAS 216321-33-4) is a chemical compound with molecular formula C11H12N4O and molecular weight 216.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine
Also Known As: J1.501.977H, 3-dimethylamino-6-phenyl-1,2,4-triazine 4-oxide, 3-(Dimethylamino)-6-phenyl-1,2,4-triazine 4-oxide, N,N-Dimethyl-6-phenyl-1,2,4-triazin-3-amine 4-oxide, 3-(dimethylamino)-6-phenyl-1,2,4-triazin-4-ium-4-olate
| Molecular Formula | C11H12N4O |
|---|---|
| Molecular Weight | 216.10 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.1011 |
| Heavy Atoms | 16 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 216321-33-4 |
|---|---|
| SMILES | CN(C)C1=[N+](C=C(N=N1)C2=CC=CC=C2)[O-] |
| InChIKey | GPYSWGGILVDBNI-UHFFFAOYSA-N |
Product Overview
N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine (CAS 216321-33-4), with molecular formula C11H12N4O and molecular weight 216.10 g/mol. IUPAC: N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine.
Chemical Property Profile of N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine
Property Insights of N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine. With a topological polar surface area (TPSA) of 54.5 Ų, N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine has 0 hydrogen bond donor(s) and 4 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 N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine?
The CAS number of N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine is 216321-33-4.
What is the molecular formula of N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine?
The molecular formula of N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine is C11H12N4O.
What is the molecular weight of N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine?
The molecular weight of N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine is 216.10 g/mol.
Where can I buy N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine?
You can request a quote for N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-4-oxido-6-phenyl-1,2,4-triazin-4-ium-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.