4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide
TL;DR: 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide (CAS 332053-03-9) is a chemical compound with molecular formula C18H21N3OS and molecular weight 327.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide
Also Known As: BAS 04935870, 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide, 4-(2-Methoxy-phenyl)-piperazine-1-carbothioic acid phenylamide, [4-(2-methoxyphenyl)piperazinyl](phenylamino)methane-1-thione
| Molecular Formula | C18H21N3OS |
|---|---|
| Molecular Weight | 327.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.14053 |
| Heavy Atoms | 23 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 332053-03-9 |
|---|---|
| SMILES | COC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=CC=CC=C3 |
| InChIKey | FMVMICHBMWFDDQ-UHFFFAOYSA-N |
Product Overview
4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide (CAS 332053-03-9), with molecular formula C18H21N3OS and molecular weight 327.14 g/mol. IUPAC: 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide.
Chemical Property Profile of 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide
Property Insights of 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide
The XLogP value of 3.3 indicates that 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.8 Ų, 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-methoxyphenyl)-N-phenylpiperazine-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 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide?
The CAS number of 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide is 332053-03-9.
What is the molecular formula of 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide?
The molecular formula of 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide is C18H21N3OS.
What is the molecular weight of 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide?
The molecular weight of 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide is 327.14 g/mol.
Where can I buy 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide?
You can request a quote for 4-(2-methoxyphenyl)-N-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 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-methoxyphenyl)-N-phenylpiperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.