(4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione
TL;DR: (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione (CAS 68209-01-8) is a chemical compound with molecular formula C15H22N2O3S and molecular weight 310.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione
Also Known As: VU0610721-1, 1-METHYL-4-(3,4,5-TRIMETHOXYBENZENECARBOTHIOYL)PIPERAZINE, (4-methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione, (4-methylpiperazin-1-yl)(3,4,5-trimethoxyphenyl)methanethione, F3322-0090
| Molecular Formula | C15H22N2O3S |
|---|---|
| Molecular Weight | 310.14 g/mol |
| LogP | 1.6353 |
| Topological Polar Surface Area | 34.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.1351 |
| Heavy Atoms | 21 |
| Complexity | 488.63535 |
Chemical Identifiers
| CAS Number | 68209-01-8 |
|---|---|
| SMILES | CN1CCN(CC1)C(=S)C2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
(4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione (CAS 68209-01-8), with molecular formula C15H22N2O3S and molecular weight 310.14 g/mol. IUPAC: (4-methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione.
Chemical Property Profile of (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione
Property Insights of (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione
The XLogP value of 1.6353 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione. With a topological polar surface area (TPSA) of 34.17 Ų, (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione has 0 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 (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione?
The CAS number of (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione is 68209-01-8.
What is the molecular formula of (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione?
The molecular formula of (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione is C15H22N2O3S.
What is the molecular weight of (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione?
The molecular weight of (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione is 310.14 g/mol.
Where can I buy (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione?
You can request a quote for (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione?
Yes, KEHONG BIO provides custom synthesis services for (4-Methylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.