N-methylpyrophthalone
TL;DR: N-methylpyrophthalone (CAS 55022-23-6) is a chemical compound with molecular formula C15H11NO2 and molecular weight 237.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methyl-2-pyridinylidene)indene-1,3-dione
Also Known As: N-methylpyrophthalone, 2-(1-methylpyridin-2-ylidene)indene-1,3-dione, 2-(1,2-Dihydro-1-methylpyridine-2-ylidene)-1,3-indandione, 2-(1-Methylpyridin-2(1H)-ylidene)-1H-indene-1,3(2H)-dione, 2-(1-methyl-1,2-dihydropyridin-2-ylidene)-2,3-dihydro-1H-indene-1,3-dione
| Molecular Formula | C15H11NO2 |
|---|---|
| Molecular Weight | 237.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 237.07898 |
| Heavy Atoms | 18 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 55022-23-6 |
|---|---|
| SMILES | CN1C=CC=CC1=C2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | OGHRXHASJDRHIX-UHFFFAOYSA-N |
Product Overview
N-methylpyrophthalone (CAS 55022-23-6), with molecular formula C15H11NO2 and molecular weight 237.08 g/mol. IUPAC: 2-(1-methyl-2-pyridinylidene)indene-1,3-dione.
Chemical Property Profile of N-methylpyrophthalone
Property Insights of N-methylpyrophthalone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methylpyrophthalone. With a topological polar surface area (TPSA) of 37.4 Ų, N-methylpyrophthalone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methylpyrophthalone has 0 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 N-methylpyrophthalone?
The CAS number of N-methylpyrophthalone is 55022-23-6.
What is the molecular formula of N-methylpyrophthalone?
The molecular formula of N-methylpyrophthalone is C15H11NO2.
What is the molecular weight of N-methylpyrophthalone?
The molecular weight of N-methylpyrophthalone is 237.08 g/mol.
Where can I buy N-methylpyrophthalone?
You can request a quote for N-methylpyrophthalone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methylpyrophthalone?
Yes, KEHONG BIO provides custom synthesis services for N-methylpyrophthalone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.