N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide
TL;DR: N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide (CAS 1005587-38-1) is a chemical compound with molecular formula C20H19ClN4O4 and molecular weight 414.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide
Also Known As: N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide, N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide, N-(5-chloro-2-methoxy-phenyl)-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide
| Molecular Formula | C20H19ClN4O4 |
|---|---|
| Molecular Weight | 414.11 g/mol |
| LogP | 4.37074 |
| Topological Polar Surface Area | 99.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.1095 |
| Heavy Atoms | 29 |
| Complexity | 1094.0804 |
Chemical Identifiers
| CAS Number | 1005587-38-1 |
|---|---|
| SMILES | CC1=C(C(=NN1CC2=CC=CC=C2C(=O)NC3=C(C=CC(=C3)Cl)OC)C)[N+](=O)[O-] |
Product Overview
N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide (CAS 1005587-38-1), with molecular formula C20H19ClN4O4 and molecular weight 414.11 g/mol. IUPAC: N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide.
Chemical Property Profile of N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Property Insights of N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide
The XLogP value of 4.37074 indicates that N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.29 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide. Following Lipinski's Rule of Five, N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide has 1 hydrogen bond donor(s) and 5 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-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide?
The CAS number of N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide is 1005587-38-1.
What is the molecular formula of N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide?
The molecular formula of N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide is C20H19ClN4O4.
What is the molecular weight of N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide?
The molecular weight of N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide is 414.11 g/mol.
Where can I buy N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide?
You can request a quote for N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-chloro-2-methoxyphenyl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.