N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide
TL;DR: N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide (CAS 516458-50-7) is a chemical compound with molecular formula C22H23N5S and molecular weight 389.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide
Also Known As: VU0047795-1, N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide, N-(4-anilinophenyl)-4-pyridin-2-yl-piperazine-1-carbothioamide, {[4-(phenylamino)phenyl]amino}(4-(2-pyridyl)piperazinyl)methane-1-thione, N-[4-(phenylamino)phenyl]-4-(pyridin-2-yl)piperazine-1-carbothioamide
| Molecular Formula | C22H23N5S |
|---|---|
| Molecular Weight | 389.17 g/mol |
| LogP | 4.3442 |
| Topological Polar Surface Area | 43.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.16742 |
| Heavy Atoms | 28 |
| Complexity | 891.22986 |
Chemical Identifiers
| CAS Number | 516458-50-7 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=CC=C(C=C3)NC4=CC=CC=C4 |
Product Overview
N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide (CAS 516458-50-7), with molecular formula C22H23N5S and molecular weight 389.17 g/mol. IUPAC: N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide.
Chemical Property Profile of N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide
Property Insights of N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide
The XLogP value of 4.3442 indicates that N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.43 Ų, N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide has 2 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 N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide?
The CAS number of N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide is 516458-50-7.
What is the molecular formula of N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide?
The molecular formula of N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide is C22H23N5S.
What is the molecular weight of N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide?
The molecular weight of N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide is 389.17 g/mol.
Where can I buy N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide?
You can request a quote for N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-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-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-anilinophenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.