1-(3-chlorobenzyl)-1H-pyrazol-4-amine
TL;DR: 1-(3-chlorobenzyl)-1H-pyrazol-4-amine (CAS 1185005-61-1) is a chemical compound with molecular formula C10H10ClN3 and molecular weight 207.05632 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(3-chlorophenyl)methyl]pyrazol-4-amine
Also Known As: 1-(3-chlorobenzyl)-1H-pyrazol-4-amine, 1-[(3-chlorophenyl)methyl]-1h-pyrazol-4-amine, 1-[(3-chlorophenyl)methyl]pyrazol-4-amine, 1-(3-CHLORO-BENZYL)-1H-PYRAZOL-4-YLAMINE, 1-(3-chlorophenyl)methyl-1H-pyrazol-4-amine
Technical Specifications
| Molecular Formula | C10H10ClN3 |
| Molecular Weight | 207.05632 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.05632 Da |
| Heavy Atoms | 14 |
| Complexity | 188.0 |
| SMILES | C1=CC(=CC(=C1)Cl)CN2C=C(C=N2)N |
| InChIKey | WHFMWXVGLGPVDW-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-chlorobenzyl)-1H-pyrazol-4-amine
Property Insights of 1-(3-chlorobenzyl)-1H-pyrazol-4-amine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-chlorobenzyl)-1H-pyrazol-4-amine. With a topological polar surface area (TPSA) of 43.8 Ų, 1-(3-chlorobenzyl)-1H-pyrazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-chlorobenzyl)-1H-pyrazol-4-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
What is the CAS number of 1-(3-chlorobenzyl)-1H-pyrazol-4-amine?
The CAS number of 1-(3-chlorobenzyl)-1H-pyrazol-4-amine is 1185005-61-1.
What is the molecular formula of 1-(3-chlorobenzyl)-1H-pyrazol-4-amine?
The molecular formula of 1-(3-chlorobenzyl)-1H-pyrazol-4-amine is C10H10ClN3.
What is the molecular weight of 1-(3-chlorobenzyl)-1H-pyrazol-4-amine?
The molecular weight of 1-(3-chlorobenzyl)-1H-pyrazol-4-amine is 207.05632 g/mol.
Where can I buy 1-(3-chlorobenzyl)-1H-pyrazol-4-amine?
You can request a quote for 1-(3-chlorobenzyl)-1H-pyrazol-4-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-chlorobenzyl)-1H-pyrazol-4-amine?
Yes, CoreyChem provides custom synthesis services for 1-(3-chlorobenzyl)-1H-pyrazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.