![{3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine structure](/static/products/879/879020-32-3.png)
{3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine
TL;DR: {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine (CAS 879020-32-3) is a chemical compound with molecular formula C15H22ClN3O and molecular weight 295.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-amino-2-chlorophenyl)piperazin-1-yl]-3-methylbutan-1-one
Also Known As: {3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine, 1-[4-(4-amino-2-chlorophenyl)piperazin-1-yl]-3-methylbutan-1-one, (3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl)amine, 1-(4-(4-amino-2-chlorophenyl)piperazin-1-yl)-3-methylbutan-1-one, 3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]aniline
| Molecular Formula | C15H22ClN3O |
|---|---|
| Molecular Weight | 295.15 g/mol |
| LogP | 2.6169 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.14514 |
| Heavy Atoms | 20 |
| Complexity | 482.00702 |
Chemical Identifiers
| CAS Number | 879020-32-3 |
|---|---|
| SMILES | CC(C)CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)N)Cl |
Product Overview
{3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine (CAS 879020-32-3), with molecular formula C15H22ClN3O and molecular weight 295.15 g/mol. IUPAC: 1-[4-(4-amino-2-chlorophenyl)piperazin-1-yl]-3-methylbutan-1-one.
Chemical Property Profile of {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine
Property Insights of {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine
The XLogP value of 2.6169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine. With a topological polar surface area (TPSA) of 49.57 Ų, {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine 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 {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine?
The CAS number of {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine is 879020-32-3.
What is the molecular formula of {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine?
The molecular formula of {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine is C15H22ClN3O.
What is the molecular weight of {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine?
The molecular weight of {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine is 295.15 g/mol.
Where can I buy {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine?
You can request a quote for {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine?
Yes, KEHONG BIO provides custom synthesis services for {3-Chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl}amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.