(E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid
TL;DR: (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid (CAS 326016-23-3) is a chemical compound with molecular formula C14H22N4O2S and molecular weight 310.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5-dimethoxyphenyl)-3-(4-methylpiperazin-1-yl)thiourea
Also Known As: (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid, 1-(2,5-dimethoxyphenyl)-3-(4-methylpiperazin-1-yl)thiourea, F0807-0128, N-(2,5-dimethoxyphenyl)-N'-(4-methyl-1-piperazinyl)thiourea, [(2,5-dimethoxyphenyl)amino][(4-methylpiperazinyl)amino]methane-1-thione
| Molecular Formula | C14H22N4O2S |
|---|---|
| Molecular Weight | 310.15 g/mol |
| LogP | 1.1526 |
| Topological Polar Surface Area | 49.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.14636 |
| Heavy Atoms | 21 |
| Complexity | 489.8624 |
Chemical Identifiers
| CAS Number | 326016-23-3 |
|---|---|
| SMILES | CN1CCN(CC1)NC(=S)NC2=C(C=CC(=C2)OC)OC |
Product Overview
(E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid (CAS 326016-23-3), with molecular formula C14H22N4O2S and molecular weight 310.15 g/mol. IUPAC: 1-(2,5-dimethoxyphenyl)-3-(4-methylpiperazin-1-yl)thiourea.
Chemical Property Profile of (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid
Property Insights of (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid
The XLogP value of 1.1526 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid. With a topological polar surface area (TPSA) of 49.0 Ų, (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid has 2 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 (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid?
The CAS number of (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid is 326016-23-3.
What is the molecular formula of (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid?
The molecular formula of (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid is C14H22N4O2S.
What is the molecular weight of (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid?
The molecular weight of (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid is 310.15 g/mol.
Where can I buy (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid?
You can request a quote for (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(2,5-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)carbamimidothioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.