N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide
TL;DR: N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide (CAS 514855-06-2) is a chemical compound with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-1-ethyl-5-methylpyrazole-4-carboxamide
Also Known As: N-(3-chlorophenyl)-1-ethyl-5-methylpyrazole-4-carboxamide, N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide, N-(3-chlorophenyl)-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide
| Molecular Formula | C13H14ClN3O |
|---|---|
| Molecular Weight | 263.08 g/mol |
| LogP | 3.11712 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.08255 |
| Heavy Atoms | 18 |
| Complexity | 577.36536 |
Chemical Identifiers
| CAS Number | 514855-06-2 |
|---|---|
| SMILES | CCN1C(=C(C=N1)C(=O)NC2=CC(=CC=C2)Cl)C |
Product Overview
N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide (CAS 514855-06-2), with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol. IUPAC: N-(3-chlorophenyl)-1-ethyl-5-methylpyrazole-4-carboxamide.
Chemical Property Profile of N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide
Property Insights of N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide
The XLogP value of 3.11712 indicates that N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide 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-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide?
The CAS number of N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide is 514855-06-2.
What is the molecular formula of N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide?
The molecular formula of N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide is C13H14ClN3O.
What is the molecular weight of N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide?
The molecular weight of N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide is 263.08 g/mol.
Where can I buy N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide?
You can request a quote for N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chlorophenyl)-1-ethyl-5-methyl-4-pyrazolecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.