RefChem:1079166
TL;DR: RefChem:1079166 (CAS 75412-57-6) is a chemical compound with molecular formula C21H17ClN4O4 and molecular weight 424.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-(2-methoxyanilino)-N-[(E)-(2-nitrophenyl)methylideneamino]benzamide
Also Known As: 4-Chloro-2-((2-methoxyphenyl)amino)benzoic acid ((2-nitrophenyl)methylene)hydrazide, Benzoic acid, 4-chloro-2-((2-methoxyphenyl)amino)-, ((2-nitrophenyl)methylene)hydrazide, RefChem:1079166, BRN 4597360
| Molecular Formula | C21H17ClN4O4 |
|---|---|
| Molecular Weight | 424.09 g/mol |
| LogP | 4.7643 |
| Topological Polar Surface Area | 105.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.09384 |
| Heavy Atoms | 30 |
| Complexity | 1117.6654 |
Chemical Identifiers
| CAS Number | 75412-57-6 |
|---|---|
| SMILES | COC1=CC=CC=C1NC2=C(C=CC(=C2)Cl)C(=O)N/N=C/C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
RefChem:1079166 (CAS 75412-57-6), with molecular formula C21H17ClN4O4 and molecular weight 424.09 g/mol. IUPAC: 4-chloro-2-(2-methoxyanilino)-N-[(E)-(2-nitrophenyl)methylideneamino]benzamide.
Chemical Property Profile of RefChem:1079166
Property Insights of RefChem:1079166
The XLogP value of 4.7643 indicates that RefChem:1079166 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.86 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1079166. Following Lipinski's Rule of Five, RefChem:1079166 has 2 hydrogen bond donor(s) and 6 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 RefChem:1079166?
The CAS number of RefChem:1079166 is 75412-57-6.
What is the molecular formula of RefChem:1079166?
The molecular formula of RefChem:1079166 is C21H17ClN4O4.
What is the molecular weight of RefChem:1079166?
The molecular weight of RefChem:1079166 is 424.09 g/mol.
Where can I buy RefChem:1079166?
You can request a quote for RefChem:1079166 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1079166?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1079166 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.