N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide
TL;DR: N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide (CAS 879458-66-9) is a chemical compound with molecular formula C17H14ClN3O2 and molecular weight 327.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide
Also Known As: AN-584/43357754, N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide, N-benzyl-5-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-3-carboxamide, N-benzyl-5-(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazole-3-carboxamide, N-benzyl-5-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide
| Molecular Formula | C17H14ClN3O2 |
|---|---|
| Molecular Weight | 327.08 g/mol |
| LogP | 3.3657 |
| Topological Polar Surface Area | 78.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.07745 |
| Heavy Atoms | 23 |
| Complexity | 830.8647 |
Chemical Identifiers
| CAS Number | 879458-66-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)C2=CC(=NN2)C3=C(C=CC(=C3)Cl)O |
Product Overview
N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide (CAS 879458-66-9), with molecular formula C17H14ClN3O2 and molecular weight 327.08 g/mol. IUPAC: N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide.
Chemical Property Profile of N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide
Property Insights of N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide
The XLogP value of 3.3657 indicates that N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.01 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide has 3 hydrogen bond donor(s) and 3 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-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide?
The CAS number of N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide is 879458-66-9.
What is the molecular formula of N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide?
The molecular formula of N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide is C17H14ClN3O2.
What is the molecular weight of N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide?
The molecular weight of N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide is 327.08 g/mol.
Where can I buy N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide?
You can request a quote for N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-3-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.