![5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide structure](/static/products/6883/688331-42-2.webp)
5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide
TL;DR: 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide (CAS 688331-42-2) is a chemical compound with molecular formula C20H21BrClN3O2 and molecular weight 449.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide
Also Known As: 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide, (5-bromo-2-chlorophenyl)-N-[4-(4-propanoylpiperazinyl)phenyl]carboxamide
| Molecular Formula | C20H21BrClN3O2 |
|---|---|
| Molecular Weight | 449.05 g/mol |
| LogP | 4.4134 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 449.05057 |
| Heavy Atoms | 27 |
| Complexity | 833.6205 |
Chemical Identifiers
| CAS Number | 688331-42-2 |
|---|---|
| SMILES | CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)Br)Cl |
Product Overview
5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide (CAS 688331-42-2), with molecular formula C20H21BrClN3O2 and molecular weight 449.05 g/mol. IUPAC: 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide.
Chemical Property Profile of 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide
Property Insights of 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide
The XLogP value of 4.4134 indicates that 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.65 Ų, 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide has 1 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 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide?
The CAS number of 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide is 688331-42-2.
What is the molecular formula of 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide?
The molecular formula of 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide is C20H21BrClN3O2.
What is the molecular weight of 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide?
The molecular weight of 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide is 449.05 g/mol.
Where can I buy 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide?
You can request a quote for 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-2-chloro-N-[4-(4-propanoylpiperazin-1-yl)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.