7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one
TL;DR: 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one (CAS 7155-17-1) is a chemical compound with molecular formula C14H9NO2 and molecular weight 223.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzoyl-7-azabicyclo[4.2.0]octa-1,3,5-trien-8-one
Also Known As: Benzoylanthranil, 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one, 7-Benzoyl-7-azabicyclo[4.2.0]octa-1,3,5-trien-8-one, 7-Benzoyl-7-azabicyclo[4.2.0]octa-1,3,5-trien-8-one #, 7-benzoyl-7-azabicyclo[4.2.0]octa-1(6),2,4-trien-8-one
| Molecular Formula | C14H9NO2 |
|---|---|
| Molecular Weight | 223.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.06332 |
| Heavy Atoms | 17 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 7155-17-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3C2=O |
| InChIKey | VVPBEWFSPBASBT-UHFFFAOYSA-N |
Product Overview
7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one (CAS 7155-17-1), with molecular formula C14H9NO2 and molecular weight 223.06 g/mol. IUPAC: 7-benzoyl-7-azabicyclo[4.2.0]octa-1,3,5-trien-8-one.
Chemical Property Profile of 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one
Property Insights of 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one. With a topological polar surface area (TPSA) of 37.4 Ų, 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-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 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one?
The CAS number of 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one is 7155-17-1.
What is the molecular formula of 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one?
The molecular formula of 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one is C14H9NO2.
What is the molecular weight of 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one?
The molecular weight of 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one is 223.06 g/mol.
Where can I buy 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one?
You can request a quote for 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.