![1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine structure](/static/products/1316/1316890-71-7.webp)
1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine
TL;DR: 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine (CAS 1316890-71-7) is a chemical compound with molecular formula C20H23N3O2 and molecular weight 337.17902 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine
Also Known As: 1-cinnamyl-4-{3-nitrobenzyl}piperazine, 1-cinnamyl-4-[(3-nitrophenyl)methyl]piperazine, AB00077891-01, 1-(3-nitrobenzyl)-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine, 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine
Technical Specifications
| Molecular Formula | C20H23N3O2 |
| Molecular Weight | 337.17902 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.17902 Da |
| Heavy Atoms | 25 |
| Complexity | 435.0 |
| SMILES | C1CN(CCN1C/C=C/C2=CC=CC=C2)CC3=CC(=CC=C3)[N+](=O)[O-] |
| InChIKey | QOXVOJOFKGEISY-WEVVVXLNSA-N |
Chemical Property Profile of 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine
Property Insights of 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine
The XLogP value of 3.5 indicates that 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine?
The CAS number of 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine is 1316890-71-7.
What is the molecular formula of 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine?
The molecular formula of 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine is C20H23N3O2.
What is the molecular weight of 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine?
The molecular weight of 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine is 337.17902 g/mol.
Where can I buy 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine?
You can request a quote for 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine?
Yes, CoreyChem provides custom synthesis services for 1-[(3-nitrophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.