4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide
TL;DR: 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide (CAS 428504-07-8) is a chemical compound with molecular formula C24H24FN3S and molecular weight 405.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide
Also Known As: 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide, 4-(diphenylmethyl)-N-(2-fluorophenyl)piperazine-1-carbothioamide
| Molecular Formula | C24H24FN3S |
|---|---|
| Molecular Weight | 405.17 g/mol |
| LogP | 4.9297 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.1675 |
| Heavy Atoms | 29 |
| Complexity | 901.1092 |
Chemical Identifiers
| CAS Number | 428504-07-8 |
|---|---|
| SMILES | C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NC4=CC=CC=C4F |
Product Overview
4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide (CAS 428504-07-8), with molecular formula C24H24FN3S and molecular weight 405.17 g/mol. IUPAC: 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide.
Chemical Property Profile of 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide
Property Insights of 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide
The XLogP value of 4.9297 indicates that 4-benzhydryl-N-(2-fluorophenyl)piperazine-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, 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide 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 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide?
The CAS number of 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide is 428504-07-8.
What is the molecular formula of 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide?
The molecular formula of 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide is C24H24FN3S.
What is the molecular weight of 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide?
The molecular weight of 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide is 405.17 g/mol.
Where can I buy 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide?
You can request a quote for 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-benzhydryl-N-(2-fluorophenyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.