![N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide structure](/static/products/4544/454434-23-2.webp)
N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide
TL;DR: N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide (CAS 454434-23-2) is a chemical compound with molecular formula C21H25N3S and molecular weight 351.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4-(3-phenylprop-2-enyl)piperazine-1-carbothioamide
Also Known As: N-benzyl-4-cinnamyl-piperazine-1-carbothioamide, N-benzyl-4-(3-phenylprop-2-enyl)piperazine-1-carbothioamide, N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide, (BENZYLAMINO)(4-(3-PHENYLPROP-2-ENYL)PIPERAZINYL)METHANE-1-THIONE, N-benzyl-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine-1-carbothioamide
| Molecular Formula | C21H25N3S |
|---|---|
| Molecular Weight | 351.18 g/mol |
| LogP | 3.3921 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.1769 |
| Heavy Atoms | 25 |
| Complexity | 676.80206 |
Chemical Identifiers
| CAS Number | 454434-23-2 |
|---|---|
| SMILES | C1CN(CCN1CC=CC2=CC=CC=C2)C(=S)NCC3=CC=CC=C3 |
Product Overview
N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide (CAS 454434-23-2), with molecular formula C21H25N3S and molecular weight 351.18 g/mol. IUPAC: N-benzyl-4-(3-phenylprop-2-enyl)piperazine-1-carbothioamide.
Chemical Property Profile of N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide
Property Insights of N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide
The XLogP value of 3.3921 indicates that N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.51 Ų, N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide 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-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide?
The CAS number of N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide is 454434-23-2.
What is the molecular formula of N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide?
The molecular formula of N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide is C21H25N3S.
What is the molecular weight of N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide?
The molecular weight of N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide is 351.18 g/mol.
Where can I buy N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide?
You can request a quote for N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-4-[(E)-3-phenyl-2-propenyl]tetrahydro-1(2H)-pyrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.