![3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid structure](/static/products/7937/793716-18-4.webp)
3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid
TL;DR: 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid (CAS 793716-18-4) is a chemical compound with molecular formula C12H8N4O2 and molecular weight 240.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)prop-2-enoic acid
Also Known As: 3-{[1,2,4]triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid, (E)-3-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)prop-2-enoic acid, (2E)-3-[1,2,4]triazolo[3,4-a]phthalazin-3-ylacrylic acid, (2E)-3-{[1,2,4]triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid, 3-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)acrylic acid
| Molecular Formula | C12H8N4O2 |
|---|---|
| Molecular Weight | 240.06 g/mol |
| LogP | 1.3753 |
| Topological Polar Surface Area | 80.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.06473 |
| Heavy Atoms | 18 |
| Complexity | 775.9439 |
Chemical Identifiers
| CAS Number | 793716-18-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=NN3C2=NN=C3/C=C/C(=O)O |
Product Overview
3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid (CAS 793716-18-4), with molecular formula C12H8N4O2 and molecular weight 240.06 g/mol. IUPAC: (E)-3-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)prop-2-enoic acid.
Chemical Property Profile of 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid
Property Insights of 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid
The XLogP value of 1.3753 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid. The TPSA of 80.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid. Following Lipinski's Rule of Five, 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid 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 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid?
The CAS number of 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid is 793716-18-4.
What is the molecular formula of 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid?
The molecular formula of 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid is C12H8N4O2.
What is the molecular weight of 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid?
The molecular weight of 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid is 240.06 g/mol.
Where can I buy 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid?
You can request a quote for 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{[1,2,4]Triazolo[3,4-a]phthalazin-3-yl}prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.