1-(4-Bromobenzoyl)azepan-2-one
TL;DR: 1-(4-Bromobenzoyl)azepan-2-one (CAS 7535-06-0) is a chemical compound with molecular formula C13H14BrNO2 and molecular weight 295.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromobenzoyl)azepan-2-one
Also Known As: 1-(4-bromobenzoyl)azepan-2-one
| Molecular Formula | C13H14BrNO2 |
|---|---|
| Molecular Weight | 295.02 g/mol |
| LogP | 2.9919 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 295.02078 |
| Heavy Atoms | 17 |
| Complexity | 427.55054 |
Chemical Identifiers
| CAS Number | 7535-06-0 |
|---|---|
| SMILES | C1CCC(=O)N(CC1)C(=O)C2=CC=C(C=C2)Br |
Product Overview
1-(4-Bromobenzoyl)azepan-2-one (CAS 7535-06-0), with molecular formula C13H14BrNO2 and molecular weight 295.02 g/mol. IUPAC: 1-(4-bromobenzoyl)azepan-2-one.
Chemical Property Profile of 1-(4-Bromobenzoyl)azepan-2-one
Property Insights of 1-(4-Bromobenzoyl)azepan-2-one
The XLogP value of 2.9919 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromobenzoyl)azepan-2-one. With a topological polar surface area (TPSA) of 37.38 Ų, 1-(4-Bromobenzoyl)azepan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromobenzoyl)azepan-2-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 1-(4-Bromobenzoyl)azepan-2-one?
The CAS number of 1-(4-Bromobenzoyl)azepan-2-one is 7535-06-0.
What is the molecular formula of 1-(4-Bromobenzoyl)azepan-2-one?
The molecular formula of 1-(4-Bromobenzoyl)azepan-2-one is C13H14BrNO2.
What is the molecular weight of 1-(4-Bromobenzoyl)azepan-2-one?
The molecular weight of 1-(4-Bromobenzoyl)azepan-2-one is 295.02 g/mol.
Where can I buy 1-(4-Bromobenzoyl)azepan-2-one?
You can request a quote for 1-(4-Bromobenzoyl)azepan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromobenzoyl)azepan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromobenzoyl)azepan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.