![1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one structure](/static/products/159/159326-71-3.webp)
1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one
TL;DR: 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one (CAS 159326-71-3) is a chemical compound with molecular formula C6H5N3O and molecular weight 135.04326 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2H-pyrrolo[1,2-d][1,2,4]triazin-1-one
Also Known As: pyrrolo[1,2-d][1,2,4]triazin-1(2H)-one, 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one, 2H-pyrrolo[1,2-d][1,2,4]triazin-1-one, 2H-Pyrrolo<1,2-d>-as-triazinon-1, PYRROLO[1,2-F][1,2,4]TRIAZIN-4(3H)-ONE
Technical Specifications
| Molecular Formula | C6H5N3O |
| Molecular Weight | 135.04326 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 46.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 135.04326 Da |
| Heavy Atoms | 10 |
| Complexity | 189.0 |
| SMILES | C1=CN2C=NNC(=O)C2=C1 |
| InChIKey | SVMRIWUVQVPFTQ-UHFFFAOYSA-N |
Chemical Property Profile of 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one
Property Insights of 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one. With a topological polar surface area (TPSA) of 46.4 Ų, 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one?
The CAS number of 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one is 159326-71-3.
What is the molecular formula of 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one?
The molecular formula of 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one is C6H5N3O.
What is the molecular weight of 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one?
The molecular weight of 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one is 135.04326 g/mol.
Where can I buy 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one?
You can request a quote for 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one?
Yes, CoreyChem provides custom synthesis services for 1H,2H-pyrrolo[1,2-d][1,2,4]triazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.