![4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one structure](/static/products/961/96101-27-8.png)
4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one
TL;DR: 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one (CAS 96101-27-8) is a chemical compound with molecular formula C10H8N4O and molecular weight 200.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one
Also Known As: [1,2,4]Triazino[4,5-a]benzimidazol-1(2H)-one,4-methyl-(9CI)|4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one|4-methyl[1,2,4]triazino[4,5-a]benzimidazol-1(2H)-one|[1,2,4]Triazino[4,5-a]benzimidazol-1(2H)-one, 4-methyl-|[1,2,4]Triazino[4,5-a]benzimidazol-1(2H)-one, 4-methyl- (9CI)
| Molecular Formula | C10H8N4O |
|---|---|
| Molecular Weight | 200.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.06981 |
| Heavy Atoms | 15 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 96101-27-8 |
|---|---|
| SMILES | CC1=NNC(=O)N2C1=NC3=CC=CC=C32 |
| InChIKey | ATAPSFWVEOBEHR-UHFFFAOYSA-N |
Product Overview
4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one (CAS 96101-27-8), with molecular formula C10H8N4O and molecular weight 200.07 g/mol. IUPAC: 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one.
Chemical Property Profile of 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one
Property Insights of 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one. With a topological polar surface area (TPSA) of 59.3 Ų, 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one 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 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one?
The CAS number of 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one is 96101-27-8.
What is the molecular formula of 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one?
The molecular formula of 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one is C10H8N4O.
What is the molecular weight of 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one?
The molecular weight of 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one is 200.07 g/mol.
Where can I buy 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one?
You can request a quote for 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-2H-[1,2,4]triazino[4,5-a]benzimidazol-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.