![N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine structure](/static/products/2999/299922-75-1.webp)
N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine
TL;DR: N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine (CAS 299922-75-1) is a chemical compound with molecular formula C12H8F5N5 and molecular weight 317.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-3-(1,1,2,2,2-pentafluoroethyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-amine
Also Known As: N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine, 3-(Perfluoroethyl)-N-methyl-1,2,4-triazolo[3,4-a]phthalazin-6-amine, 1,2,4-Triazolo[3,4-a]phthalazin-6-amine, 3-(1,1,2,2,2-pentafluoroethyl)-N-methyl-, N-methyl-3-(1,1,2,2,2-pentafluoroethyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-amine, N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine #
| Molecular Formula | C12H8F5N5 |
|---|---|
| Molecular Weight | 317.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.06998 |
| Heavy Atoms | 22 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 299922-75-1 |
|---|---|
| SMILES | CNC1=NN2C(=NN=C2C(C(F)(F)F)(F)F)C3=CC=CC=C31 |
| InChIKey | RREMVRQSSUOSIU-UHFFFAOYSA-N |
Product Overview
N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine (CAS 299922-75-1), with molecular formula C12H8F5N5 and molecular weight 317.07 g/mol. IUPAC: N-methyl-3-(1,1,2,2,2-pentafluoroethyl)-[1,2,4]triazolo[3,4-a]phthalazin-6-amine.
Chemical Property Profile of N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine
Property Insights of N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine. With a topological polar surface area (TPSA) of 55.1 Ų, N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine has 1 hydrogen bond donor(s) and 9 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-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine?
The CAS number of N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine is 299922-75-1.
What is the molecular formula of N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine?
The molecular formula of N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine is C12H8F5N5.
What is the molecular weight of N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine?
The molecular weight of N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine is 317.07 g/mol.
Where can I buy N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine?
You can request a quote for N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-3-(1,1,2,2,2-pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.