![{[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine structure](/static/products/100/1002511-85-4.png)
{[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine
TL;DR: {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine (CAS 1002511-85-4) is a chemical compound with molecular formula C21H21N3 and molecular weight 315.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[1-benzyl-3-(4-methylphenyl)pyrazol-4-yl]methyl]prop-2-yn-1-amine
Also Known As: AB00747759-01, N-[[1-benzyl-3-(4-methylphenyl)pyrazol-4-yl]methyl]prop-2-yn-1-amine, {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine
| Molecular Formula | C21H21N3 |
|---|---|
| Molecular Weight | 315.17 g/mol |
| LogP | 3.62962 |
| Topological Polar Surface Area | 29.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.17355 |
| Heavy Atoms | 24 |
| Complexity | 823.77045 |
Chemical Identifiers
| CAS Number | 1002511-85-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN(C=C2CNCC#C)CC3=CC=CC=C3 |
Product Overview
{[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine (CAS 1002511-85-4), with molecular formula C21H21N3 and molecular weight 315.17 g/mol. IUPAC: N-[[1-benzyl-3-(4-methylphenyl)pyrazol-4-yl]methyl]prop-2-yn-1-amine.
Chemical Property Profile of {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine
Property Insights of {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine
The XLogP value of 3.62962 indicates that {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.85 Ų, {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine has 1 hydrogen bond donor(s) and 2 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 {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine?
The CAS number of {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine is 1002511-85-4.
What is the molecular formula of {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine?
The molecular formula of {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine is C21H21N3.
What is the molecular weight of {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine?
The molecular weight of {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine is 315.17 g/mol.
Where can I buy {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine?
You can request a quote for {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine?
Yes, KEHONG BIO provides custom synthesis services for {[1-benzyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}(prop-2-yn-1-yl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.