![N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide structure](/static/products/1040/104017-61-0.webp)
N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide
TL;DR: N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide (CAS 104017-61-0) is a chemical compound with molecular formula C19H17F6N3S and molecular weight 433.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide
Also Known As: N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide, N-[3,5-bis(trifluoromethyl)phenyl]-4-phenyl-piperazine-1-carbothioamide, ((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)(4-PHENYLPIPERAZINYL)METHANE-1-THIONE, N-[3,5-bis(trifluoromethyl)phenyl]-4-phenyltetrahydro-1(2H)-pyrazinecarbothioamide, C19H17F6N3S
| Molecular Formula | C19H17F6N3S |
|---|---|
| Molecular Weight | 433.10 g/mol |
| LogP | 5.2432 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 433.10474 |
| Heavy Atoms | 29 |
| Complexity | 826.2336 |
Chemical Identifiers
| CAS Number | 104017-61-0 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)C(=S)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F |
Product Overview
N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide (CAS 104017-61-0), with molecular formula C19H17F6N3S and molecular weight 433.10 g/mol. IUPAC: N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide.
Chemical Property Profile of N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide
Property Insights of N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide
The XLogP value of 5.2432 indicates that N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide 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-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide?
The CAS number of N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide is 104017-61-0.
What is the molecular formula of N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide?
The molecular formula of N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide is C19H17F6N3S.
What is the molecular weight of N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide?
The molecular weight of N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide is 433.10 g/mol.
Where can I buy N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide?
You can request a quote for N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3,5-bis(trifluoromethyl)phenyl]-4-phenylpiperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.