![4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol structure](/static/products/5002/500269-91-0.webp)
4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol
TL;DR: 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol (CAS 500269-91-0) is a chemical compound with molecular formula C12H16N2OS and molecular weight 236.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxyphenyl)-(4-methylpiperazin-1-yl)methanethione
Also Known As: 4-[(4-methyl-1-piperazinyl)carbothioyl]phenol, (4-hydroxyphenyl)(4-methylpiperazin-1-yl)methanethione, AO-081/41965602, 4-[(4-methylpiperazin-1-yl)-sulfanylmethylidene]cyclohexa-2,5-dien-1-one
| Molecular Formula | C12H16N2OS |
|---|---|
| Molecular Weight | 236.10 g/mol |
| LogP | 1.3151 |
| Topological Polar Surface Area | 26.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.09833 |
| Heavy Atoms | 16 |
| Complexity | 369.11008 |
Chemical Identifiers
| CAS Number | 500269-91-0 |
|---|---|
| SMILES | CN1CCN(CC1)C(=S)C2=CC=C(C=C2)O |
Product Overview
4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol (CAS 500269-91-0), with molecular formula C12H16N2OS and molecular weight 236.10 g/mol. IUPAC: (4-hydroxyphenyl)-(4-methylpiperazin-1-yl)methanethione.
Chemical Property Profile of 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol
Property Insights of 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol
The XLogP value of 1.3151 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol. With a topological polar surface area (TPSA) of 26.71 Ų, 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol 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-[(4-Methyl-1-piperazinyl)carbothioyl]phenol?
The CAS number of 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol is 500269-91-0.
What is the molecular formula of 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol?
The molecular formula of 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol is C12H16N2OS.
What is the molecular weight of 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol?
The molecular weight of 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol is 236.10 g/mol.
Where can I buy 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol?
You can request a quote for 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Methyl-1-piperazinyl)carbothioyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.