(E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide
TL;DR: (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide (CAS 885179-52-2) is a chemical compound with molecular formula C22H24N4O and molecular weight 360.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoprop-2-enamide
Also Known As: (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide, VU0605190-1, (2E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoprop-2-enamide, (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoprop-2-enamide, F3225-7634
| Molecular Formula | C22H24N4O |
|---|---|
| Molecular Weight | 360.19 g/mol |
| LogP | 2.52808 |
| Topological Polar Surface Area | 59.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 360.195 |
| Heavy Atoms | 27 |
| Complexity | 803.21136 |
Chemical Identifiers
| CAS Number | 885179-52-2 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)/C=C(\C#N)/C(=O)NCC3=CC=CC=C3 |
Product Overview
(E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide (CAS 885179-52-2), with molecular formula C22H24N4O and molecular weight 360.19 g/mol. IUPAC: (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoprop-2-enamide.
Chemical Property Profile of (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide
Property Insights of (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide
The XLogP value of 2.52808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide. With a topological polar surface area (TPSA) of 59.37 Ų, (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide has 1 hydrogen bond donor(s) and 4 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-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide?
The CAS number of (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide is 885179-52-2.
What is the molecular formula of (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide?
The molecular formula of (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide is C22H24N4O.
What is the molecular weight of (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide?
The molecular weight of (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide is 360.19 g/mol.
Where can I buy (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide?
You can request a quote for (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-benzyl-3-(4-benzylpiperazin-1-yl)-2-cyanoacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.