6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one
TL;DR: 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one (CAS 4678-27-7) is a chemical compound with molecular formula C15H10ClNO and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one
Also Known As: 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one, 6-Chloro-2-[(pyridin-3-yl)methylidene]-2,3-dihydro-1H-inden-1-one
| Molecular Formula | C15H10ClNO |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 3.5574 |
| Topological Polar Surface Area | 29.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.04509 |
| Heavy Atoms | 18 |
| Complexity | 646.7981 |
Chemical Identifiers
| CAS Number | 4678-27-7 |
|---|---|
| SMILES | C1C2=C(C=C(C=C2)Cl)C(=O)C1=CC3=CN=CC=C3 |
Product Overview
6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one (CAS 4678-27-7), with molecular formula C15H10ClNO and molecular weight 255.05 g/mol. IUPAC: 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one.
Chemical Property Profile of 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one
Property Insights of 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one
The XLogP value of 3.5574 indicates that 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.96 Ų, 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one 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 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one?
The CAS number of 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one is 4678-27-7.
What is the molecular formula of 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one?
The molecular formula of 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one is C15H10ClNO.
What is the molecular weight of 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one?
The molecular weight of 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one is 255.05 g/mol.
Where can I buy 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one?
You can request a quote for 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-2-(pyridin-3-ylmethylidene)-3H-inden-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.