1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine
TL;DR: 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine (CAS 925179-59-5) is a chemical compound with molecular formula C11H11ClFN3 and molecular weight 239.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chloro-4-fluorophenyl)methyl]-5-methylpyrazol-3-amine
Also Known As: 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine, ZERO/005388, 1-[(2-chloro-4-fluorophenyl)methyl]-5-methylpyrazol-3-amine, 1-[(2-chloro-4-fluorophenyl)methyl]-5-methyl-1h-pyrazol-3-amine, 1-Difluoromethyl-1H-pyrazole-3-carboxylic acid
| Molecular Formula | C11H11ClFN3 |
|---|---|
| Molecular Weight | 239.06 g/mol |
| LogP | 2.61452 |
| Topological Polar Surface Area | 43.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.06255 |
| Heavy Atoms | 16 |
| Complexity | 521.94336 |
Chemical Identifiers
| CAS Number | 925179-59-5 |
|---|---|
| SMILES | CC1=CC(=NN1CC2=C(C=C(C=C2)F)Cl)N |
Product Overview
1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine (CAS 925179-59-5), with molecular formula C11H11ClFN3 and molecular weight 239.06 g/mol. IUPAC: 1-[(2-chloro-4-fluorophenyl)methyl]-5-methylpyrazol-3-amine.
Chemical Property Profile of 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine
Property Insights of 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine
The XLogP value of 2.61452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine. With a topological polar surface area (TPSA) of 43.84 Ų, 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-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-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine?
The CAS number of 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine is 925179-59-5.
What is the molecular formula of 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine?
The molecular formula of 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine is C11H11ClFN3.
What is the molecular weight of 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine?
The molecular weight of 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine is 239.06 g/mol.
Where can I buy 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine?
You can request a quote for 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-chloro-4-fluorobenzyl)-5-methyl-1H-pyrazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.