(E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide
TL;DR: (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide (CAS 897548-17-3) is a chemical compound with molecular formula C23H26ClN3O2 and molecular weight 411.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-chloro-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-methylpropanamide
Also Known As: (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide, N-(3-chloro-4-{4-[(2E)-3-phenylprop-2-enoyl]piperazin-1-yl}phenyl)-2-methylpropanamide, N-[3-chloro-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-methylpropanamide
| Molecular Formula | C23H26ClN3O2 |
|---|---|
| Molecular Weight | 411.17 g/mol |
| LogP | 4.2965 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.17136 |
| Heavy Atoms | 29 |
| Complexity | 888.2509 |
Chemical Identifiers
| CAS Number | 897548-17-3 |
|---|---|
| SMILES | CC(C)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3)Cl |
Product Overview
(E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide (CAS 897548-17-3), with molecular formula C23H26ClN3O2 and molecular weight 411.17 g/mol. IUPAC: N-[3-chloro-4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-2-methylpropanamide.
Chemical Property Profile of (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide
Property Insights of (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide
The XLogP value of 4.2965 indicates that (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.65 Ų, (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide 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 (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide?
The CAS number of (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide is 897548-17-3.
What is the molecular formula of (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide?
The molecular formula of (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide is C23H26ClN3O2.
What is the molecular weight of (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide?
The molecular weight of (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide is 411.17 g/mol.
Where can I buy (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide?
You can request a quote for (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3-chloro-4-(4-cinnamoylpiperazin-1-yl)phenyl)isobutyramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.