N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide
TL;DR: N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide (CAS 1001500-12-4) is a chemical compound with molecular formula C12H11Cl2N3O and molecular weight 283.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-benzyl-4-chloropyrazol-3-yl)-2-chloroacetamide
Also Known As: N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide, N-(1-Benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloro-acetamide, N-(1-benzyl-4-chloropyrazol-3-yl)-2-chloroacetamide, 2-chloro-N-[4-chloro-1-benzylpyrazol-3-yl]acetamide, 2-Chloro-N-[4-chloro-1-(phenylmethyl)-1H-pyrazol-3-yl]acetamide
| Molecular Formula | C12H11Cl2N3O |
|---|---|
| Molecular Weight | 283.03 g/mol |
| LogP | 2.7621 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.02792 |
| Heavy Atoms | 18 |
| Complexity | 539.5105 |
Chemical Identifiers
| CAS Number | 1001500-12-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C=C(C(=N2)NC(=O)CCl)Cl |
Product Overview
N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide (CAS 1001500-12-4), with molecular formula C12H11Cl2N3O and molecular weight 283.03 g/mol. IUPAC: N-(1-benzyl-4-chloropyrazol-3-yl)-2-chloroacetamide.
Chemical Property Profile of N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide
Property Insights of N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide
The XLogP value of 2.7621 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide. With a topological polar surface area (TPSA) of 46.92 Ų, N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide 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 N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide?
The CAS number of N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide is 1001500-12-4.
What is the molecular formula of N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide?
The molecular formula of N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide is C12H11Cl2N3O.
What is the molecular weight of N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide?
The molecular weight of N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide is 283.03 g/mol.
Where can I buy N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide?
You can request a quote for N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-chloroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.