2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone
TL;DR: 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone (CAS 61802-66-2) is a chemical compound with molecular formula C23H18N4O and molecular weight 366.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone
Also Known As: 2-(3-imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone, 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2(3H)-yl)-1-phenylethan-1-one
| Molecular Formula | C23H18N4O |
|---|---|
| Molecular Weight | 366.15 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.14807 |
| Heavy Atoms | 28 |
| Complexity | 635.0 |
Chemical Identifiers
| CAS Number | 61802-66-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=N)N(N=C2C3=CC=CC=C3)CC(=O)C4=CC=CC=C4 |
| InChIKey | DJVKWCQUGQLXTB-UHFFFAOYSA-N |
Product Overview
2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone (CAS 61802-66-2), with molecular formula C23H18N4O and molecular weight 366.15 g/mol. IUPAC: 2-(3-imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone.
Chemical Property Profile of 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone
Property Insights of 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone
The XLogP value of 4.3 indicates that 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone. Following Lipinski's Rule of Five, 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone has 1 hydrogen bond donor(s) and 3 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 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone?
The CAS number of 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone is 61802-66-2.
What is the molecular formula of 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone?
The molecular formula of 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone is C23H18N4O.
What is the molecular weight of 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone?
The molecular weight of 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone is 366.15 g/mol.
Where can I buy 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone?
You can request a quote for 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Imino-5,6-diphenyl-1,2,4-triazin-2-yl)-1-phenylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.