N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide
TL;DR: N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide (CAS 772997-46-3) is a chemical compound with molecular formula C18H27N3O and molecular weight 301.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide
Also Known As: N-butyl-4-cinnamyl-piperazine-1-carboxamide, N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide, N-butyl-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine-1-carboxamide, [4-((2E)-3-phenylprop-2-enyl)piperazinyl]-N-butylcarboxamide, N-butyl-4-(3-phenyl-2-propen-1-yl)-1-piperazinecarboxamide
| Molecular Formula | C18H27N3O |
|---|---|
| Molecular Weight | 301.22 g/mol |
| LogP | 2.8271 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.21542 |
| Heavy Atoms | 22 |
| Complexity | 464.48044 |
Chemical Identifiers
| CAS Number | 772997-46-3 |
|---|---|
| SMILES | CCCCNC(=O)N1CCN(CC1)C/C=C/C2=CC=CC=C2 |
Product Overview
N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide (CAS 772997-46-3), with molecular formula C18H27N3O and molecular weight 301.22 g/mol. IUPAC: N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide.
Chemical Property Profile of N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide
Property Insights of N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide
The XLogP value of 2.8271 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide. With a topological polar surface area (TPSA) of 35.58 Ų, N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide has 1 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 N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide?
The CAS number of N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide is 772997-46-3.
What is the molecular formula of N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide?
The molecular formula of N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide is C18H27N3O.
What is the molecular weight of N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide?
The molecular weight of N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide is 301.22 g/mol.
Where can I buy N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide?
You can request a quote for N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazine-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.