4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine
TL;DR: 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine (CAS 1004452-00-9) is a chemical compound with molecular formula C11H9ClF3N3 and molecular weight 275.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-3-amine
Also Known As: 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine, 4-chloro-1-[3-(trifluoromethyl)benzyl]-1H-pyrazol-3-amine, 1-Acetamido-3-amino-2,6-dimethylbenzene, 4-Chloro-1-(3-trifluoromethyl-benzyl)-1H-pyrazol-3-ylamine, 4-chloro-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-3-amine
| Molecular Formula | C11H9ClF3N3 |
|---|---|
| Molecular Weight | 275.04 g/mol |
| LogP | 3.1858 |
| Topological Polar Surface Area | 43.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.0437 |
| Heavy Atoms | 18 |
| Complexity | 543.40137 |
Chemical Identifiers
| CAS Number | 1004452-00-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)CN2C=C(C(=N2)N)Cl |
Product Overview
4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine (CAS 1004452-00-9), with molecular formula C11H9ClF3N3 and molecular weight 275.04 g/mol. IUPAC: 4-chloro-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-3-amine.
Chemical Property Profile of 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine
Property Insights of 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine
The XLogP value of 3.1858 indicates that 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.84 Ų, 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-1-(3-(trifluoromethyl)benzyl)-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 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine?
The CAS number of 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine is 1004452-00-9.
What is the molecular formula of 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine?
The molecular formula of 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine is C11H9ClF3N3.
What is the molecular weight of 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine?
The molecular weight of 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine is 275.04 g/mol.
Where can I buy 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine?
You can request a quote for 4-Chloro-1-(3-(trifluoromethyl)benzyl)-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 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-1-(3-(trifluoromethyl)benzyl)-1H-pyrazol-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.