1-Indanone, 2-(3-pyridylmethylene)-
TL;DR: 1-Indanone, 2-(3-pyridylmethylene)- (CAS 4875-90-5) is a chemical compound with molecular formula C15H11NO and molecular weight 221.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridin-3-ylmethylidene)-3H-inden-1-one
Also Known As: 2-(3-Picolylidene)-1-indanone, 2-(3-Pyridylmethylene)1-indanone, 1-Indanone, 2-(3-pyridylmethylene)-, 2-(3-Pyridylmethylene)-1-indanone, 2-(pyridin-3-ylmethylidene)-3H-inden-1-one
| Molecular Formula | C15H11NO |
|---|---|
| Molecular Weight | 221.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.08406 |
| Heavy Atoms | 17 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 4875-90-5 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)C1=CC3=CN=CC=C3 |
| InChIKey | UCAONOPVOXJPQZ-UHFFFAOYSA-N |
Product Overview
1-Indanone, 2-(3-pyridylmethylene)- (CAS 4875-90-5), with molecular formula C15H11NO and molecular weight 221.08 g/mol. IUPAC: 2-(pyridin-3-ylmethylidene)-3H-inden-1-one.
Chemical Property Profile of 1-Indanone, 2-(3-pyridylmethylene)-
Property Insights of 1-Indanone, 2-(3-pyridylmethylene)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Indanone, 2-(3-pyridylmethylene)-. With a topological polar surface area (TPSA) of 30.0 Ų, 1-Indanone, 2-(3-pyridylmethylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Indanone, 2-(3-pyridylmethylene)- has 0 hydrogen bond donor(s) and 2 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 1-Indanone, 2-(3-pyridylmethylene)-?
The CAS number of 1-Indanone, 2-(3-pyridylmethylene)- is 4875-90-5.
What is the molecular formula of 1-Indanone, 2-(3-pyridylmethylene)-?
The molecular formula of 1-Indanone, 2-(3-pyridylmethylene)- is C15H11NO.
What is the molecular weight of 1-Indanone, 2-(3-pyridylmethylene)-?
The molecular weight of 1-Indanone, 2-(3-pyridylmethylene)- is 221.08 g/mol.
Where can I buy 1-Indanone, 2-(3-pyridylmethylene)-?
You can request a quote for 1-Indanone, 2-(3-pyridylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Indanone, 2-(3-pyridylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Indanone, 2-(3-pyridylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.