1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate
TL;DR: 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate (CAS 299907-68-9) is a chemical compound with molecular formula C14H8BF2NO2 and molecular weight 271.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-difluoroboranyloxy-2-pyridin-3-ylinden-1-one
Also Known As: 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate, 3-difluoroboranyloxy-2-pyridin-3-yl-inden-1-one, 3-difluoroboranyloxy-2-pyridin-3-ylinden-1-one, 3-((difluoroboryl)oxy)-2-(pyridin-3-yl)-1H-inden-1-one, 1-OXO-2-(3-PYRIDINYL)-1H-INDEN-3-YL DIFLUORIDOBORATE
| Molecular Formula | C14H8BF2NO2 |
|---|---|
| Molecular Weight | 271.06 g/mol |
| LogP | 3.0867 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.0616 |
| Heavy Atoms | 20 |
| Complexity | 701.3299 |
Chemical Identifiers
| CAS Number | 299907-68-9 |
|---|---|
| SMILES | B(OC1=C(C(=O)C2=CC=CC=C21)C3=CN=CC=C3)(F)F |
Product Overview
1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate (CAS 299907-68-9), with molecular formula C14H8BF2NO2 and molecular weight 271.06 g/mol. IUPAC: 3-difluoroboranyloxy-2-pyridin-3-ylinden-1-one.
Chemical Property Profile of 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate
Property Insights of 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate
The XLogP value of 3.0867 indicates that 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate 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 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate?
The CAS number of 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate is 299907-68-9.
What is the molecular formula of 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate?
The molecular formula of 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate is C14H8BF2NO2.
What is the molecular weight of 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate?
The molecular weight of 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate is 271.06 g/mol.
Where can I buy 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate?
You can request a quote for 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate?
Yes, KEHONG BIO provides custom synthesis services for 1-oxo-2-(pyridin-3-yl)-1H-inden-3-yl borodifluoridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.