1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt)
TL;DR: 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt) (CAS 62906-55-2) is a chemical compound with molecular formula C26H38N4O8S2 and molecular weight 598.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol;methanesulfonic acid
Also Known As: 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt), 2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol; methanesulfonic acid, Methanesulfonic acid--2-(4-{3-[(1,4-diphenyl-1H-pyrazol-3-yl)oxy]propyl}piperazin-1-yl)ethan-1-ol (2/1), RefChem:233749
| Molecular Formula | C26H38N4O8S2 |
|---|---|
| Molecular Weight | 598.21 g/mol |
| LogP | 1.9261 |
| Topological Polar Surface Area | 162.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 598.21313 |
| Heavy Atoms | 40 |
| Complexity | 1297.8556 |
Chemical Identifiers
| CAS Number | 62906-55-2 |
|---|---|
| SMILES | CS(=O)(=O)O.CS(=O)(=O)O.C1CN(CCN1CCCOC2=NN(C=C2C3=CC=CC=C3)C4=CC=CC=C4)CCO |
Product Overview
1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt) (CAS 62906-55-2), with molecular formula C26H38N4O8S2 and molecular weight 598.21 g/mol. IUPAC: 2-[4-[3-(1,4-diphenylpyrazol-3-yl)oxypropyl]piperazin-1-yl]ethanol;methanesulfonic acid.
Chemical Property Profile of 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt)
Property Insights of 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt)
The XLogP value of 1.9261 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt). The TPSA of 162.5 Ų indicates high polarity, suggesting 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt) has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt)?
The CAS number of 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt) is 62906-55-2.
What is the molecular formula of 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt)?
The molecular formula of 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt) is C26H38N4O8S2.
What is the molecular weight of 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt)?
The molecular weight of 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt) is 598.21 g/mol.
Where can I buy 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt)?
You can request a quote for 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt)?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazineethanol, 4-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-, dimethanesulfonate (salt) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.