N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate
TL;DR: N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate (CAS 62832-85-3) is a chemical compound with molecular formula C22H29N3O4S and molecular weight 431.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]butan-1-amine;methanesulfonic acid
Also Known As: N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate, 1-Butanamine, N-(2-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-, monomethanesulfonate, N-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]butan-1-amine, N-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]butan-1-amine,methanesulfonic acid, Methanesulfonic acid--N-{2-[(1,4-diphenyl-1H-pyrazol-3-yl)oxy]ethyl}butan-1-amine (1/1)
| Molecular Formula | C22H29N3O4S |
|---|---|
| Molecular Weight | 431.19 g/mol |
| LogP | 3.8118 |
| Topological Polar Surface Area | 93.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 431.18787 |
| Heavy Atoms | 30 |
| Complexity | 966.13196 |
Chemical Identifiers
| CAS Number | 62832-85-3 |
|---|---|
| SMILES | CCCCNCCOC1=NN(C=C1C2=CC=CC=C2)C3=CC=CC=C3.CS(=O)(=O)O |
Product Overview
N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate (CAS 62832-85-3), with molecular formula C22H29N3O4S and molecular weight 431.19 g/mol. IUPAC: N-[2-(1,4-diphenylpyrazol-3-yl)oxyethyl]butan-1-amine;methanesulfonic acid.
Chemical Property Profile of N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate
Property Insights of N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate
The XLogP value of 3.8118 indicates that N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate. Following Lipinski's Rule of Five, N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate 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 N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate?
The CAS number of N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate is 62832-85-3.
What is the molecular formula of N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate?
The molecular formula of N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate is C22H29N3O4S.
What is the molecular weight of N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate?
The molecular weight of N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate is 431.19 g/mol.
Where can I buy N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate?
You can request a quote for N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for N-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-1-butanamine monomethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.