2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid
TL;DR: 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid (CAS 332886-32-5) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-1-oxophthalazin-2-yl)propanoic acid
Also Known As: 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid, 2-(4-methyl-1-oxophthalazin-2(1H)-yl)propanoic acid, BAS 00692341, 2-(4-methyl-1-oxophthalazin-2-yl)propanoic acid, 2-(4-methyl-1-oxo-2-phthalazinyl)propanoic acid
| Molecular Formula | C12H12N2O3 |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 1.35052 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.0848 |
| Heavy Atoms | 17 |
| Complexity | 645.7311 |
Chemical Identifiers
| CAS Number | 332886-32-5 |
|---|---|
| SMILES | CC1=NN(C(=O)C2=CC=CC=C12)C(C)C(=O)O |
Product Overview
2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid (CAS 332886-32-5), with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol. IUPAC: 2-(4-methyl-1-oxophthalazin-2-yl)propanoic acid.
Chemical Property Profile of 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid
Property Insights of 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid
The XLogP value of 1.35052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid. Following Lipinski's Rule of Five, 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid 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 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid?
The CAS number of 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid is 332886-32-5.
What is the molecular formula of 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid?
The molecular formula of 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid is C12H12N2O3.
What is the molecular weight of 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid?
The molecular weight of 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid is 232.08 g/mol.
Where can I buy 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid?
You can request a quote for 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methyl-1-oxo-1H-phthalazin-2-yl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.