Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride
TL;DR: Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride (CAS 70733-78-7) is a chemical compound with molecular formula C14H21ClN2O3S and molecular weight 332.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
piperazin-1-yl-(3,4,5-trimethoxyphenyl)methanethione;hydrochloride
Also Known As: 1-(3,4,5-Trimethoxythiobenzoyl)piperazine hydrochloride, Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride, piperazin-1-yl-(3,4,5-trimethoxyphenyl)methanethione hydrochloride, Piperazine, 1-[thioxo(3,4,5-trimethoxyphenyl)methyl]-, monohydrochloride, (Piperazin-1-yl)(3,4,5-trimethoxyphenyl)methanethione--hydrogen chloride (1/1)
| Molecular Formula | C14H21ClN2O3S |
|---|---|
| Molecular Weight | 332.10 g/mol |
| LogP | 1.7149 |
| Topological Polar Surface Area | 42.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.09613 |
| Heavy Atoms | 21 |
| Complexity | 468.10263 |
Chemical Identifiers
| CAS Number | 70733-78-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=S)N2CCNCC2.Cl |
Product Overview
Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride (CAS 70733-78-7), with molecular formula C14H21ClN2O3S and molecular weight 332.10 g/mol. IUPAC: piperazin-1-yl-(3,4,5-trimethoxyphenyl)methanethione;hydrochloride.
Chemical Property Profile of Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride
Property Insights of Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride
The XLogP value of 1.7149 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride. With a topological polar surface area (TPSA) of 42.96 Ų, Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride has 1 hydrogen bond donor(s) and 5 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 Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride?
The CAS number of Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride is 70733-78-7.
What is the molecular formula of Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride?
The molecular formula of Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride is C14H21ClN2O3S.
What is the molecular weight of Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride?
The molecular weight of Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride is 332.10 g/mol.
Where can I buy Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride?
You can request a quote for Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Piperazine, 1-(3,4,5-trimethoxythiobenzoyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.