2-(4-Pyridylmethylene) indan-1,3-dione
TL;DR: 2-(4-Pyridylmethylene) indan-1,3-dione (CAS 31060-61-4) is a chemical compound with molecular formula C15H9NO2 and molecular weight 235.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridin-4-ylmethylidene)indene-1,3-dione
Also Known As: 2-(4-pyridylmethylene) indan-1,3-dione, 2-(pyridin-4-ylmethylidene)indene-1,3-dione, 1H-Indene-1,3(2H)-dione, 2-(4-pyridinylmethylene)-, 2-(4-pyridylmethylene)cyclopenta[1,2-a]benzene-1,3-dione, 2-[(Pyridin-4-yl)methylidene]-1H-indene-1,3(2H)-dione
| Molecular Formula | C15H9NO2 |
|---|---|
| Molecular Weight | 235.06 g/mol |
| LogP | 2.5442 |
| Topological Polar Surface Area | 47.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.06332 |
| Heavy Atoms | 18 |
| Complexity | 634.9028 |
Chemical Identifiers
| CAS Number | 31060-61-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=CC3=CC=NC=C3)C2=O |
Product Overview
2-(4-Pyridylmethylene) indan-1,3-dione (CAS 31060-61-4), with molecular formula C15H9NO2 and molecular weight 235.06 g/mol. IUPAC: 2-(pyridin-4-ylmethylidene)indene-1,3-dione.
Chemical Property Profile of 2-(4-Pyridylmethylene) indan-1,3-dione
Property Insights of 2-(4-Pyridylmethylene) indan-1,3-dione
The XLogP value of 2.5442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Pyridylmethylene) indan-1,3-dione. With a topological polar surface area (TPSA) of 47.03 Ų, 2-(4-Pyridylmethylene) indan-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Pyridylmethylene) indan-1,3-dione 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 2-(4-Pyridylmethylene) indan-1,3-dione?
The CAS number of 2-(4-Pyridylmethylene) indan-1,3-dione is 31060-61-4.
What is the molecular formula of 2-(4-Pyridylmethylene) indan-1,3-dione?
The molecular formula of 2-(4-Pyridylmethylene) indan-1,3-dione is C15H9NO2.
What is the molecular weight of 2-(4-Pyridylmethylene) indan-1,3-dione?
The molecular weight of 2-(4-Pyridylmethylene) indan-1,3-dione is 235.06 g/mol.
Where can I buy 2-(4-Pyridylmethylene) indan-1,3-dione?
You can request a quote for 2-(4-Pyridylmethylene) indan-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Pyridylmethylene) indan-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Pyridylmethylene) indan-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.