![[1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one structure](/static/products/2579/257955-44-5.webp)
[1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one
TL;DR: [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one (CAS 257955-44-5) is a chemical compound with molecular formula C9H6N4O and molecular weight 186.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-[1,2,4]triazino[4,3-a]benzimidazol-4-one
Also Known As: NCI60_028323, [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one, J1.266.958E, [1,2,4]Triazino[4,3-a]benzimidazol-4 -one, 1H-[1,2,4]triazino[4,3-a]benzimidazol-4-one
| Molecular Formula | C9H6N4O |
|---|---|
| Molecular Weight | 186.05 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.05415 |
| Heavy Atoms | 14 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 257955-44-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3N2C(=O)C=NN3 |
| InChIKey | UTTCYYFYTSCSMS-UHFFFAOYSA-N |
Product Overview
[1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one (CAS 257955-44-5), with molecular formula C9H6N4O and molecular weight 186.05 g/mol. IUPAC: 1H-[1,2,4]triazino[4,3-a]benzimidazol-4-one.
Chemical Property Profile of [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one
Property Insights of [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one. With a topological polar surface area (TPSA) of 59.3 Ų, [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one has 1 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 [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one?
The CAS number of [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one is 257955-44-5.
What is the molecular formula of [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one?
The molecular formula of [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one is C9H6N4O.
What is the molecular weight of [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one?
The molecular weight of [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one is 186.05 g/mol.
Where can I buy [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one?
You can request a quote for [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for [1,2,4]Triazino[4,3-a]benzimidazol-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.