N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
TL;DR: N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide (CAS 433314-79-5) is a chemical compound with molecular formula C20H25N3OS and molecular weight 355.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
Also Known As: BAS 04935877, N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide, 4-(4-Methoxy-phenyl)-piperazine-1-carbothioic acid (3,5-dimethyl-phenyl)-amide, [(3,5-dimethylphenyl)amino][4-(4-methoxyphenyl)piperazinyl]methane-1-thione, N-(3,5-DIMETHYLPHENYL)-4-(4-METHOXYPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOTHIOAMIDE
| Molecular Formula | C20H25N3OS |
|---|---|
| Molecular Weight | 355.17 g/mol |
| LogP | 3.83104 |
| Topological Polar Surface Area | 27.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.17184 |
| Heavy Atoms | 25 |
| Complexity | 716.8565 |
Chemical Identifiers
| CAS Number | 433314-79-5 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)OC)C |
Product Overview
N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide (CAS 433314-79-5), with molecular formula C20H25N3OS and molecular weight 355.17 g/mol. IUPAC: N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide.
Chemical Property Profile of N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
Property Insights of N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide
The XLogP value of 3.83104 indicates that N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.74 Ų, N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide has 1 hydrogen bond donor(s) and 3 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-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide?
The CAS number of N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide is 433314-79-5.
What is the molecular formula of N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide?
The molecular formula of N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide is C20H25N3OS.
What is the molecular weight of N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide?
The molecular weight of N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide is 355.17 g/mol.
Where can I buy N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide?
You can request a quote for N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)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 N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,5-dimethylphenyl)-4-(4-methoxyphenyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.