3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide
TL;DR: 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide (CAS 634592-73-7) is a chemical compound with molecular formula C21H13ClN4O4 and molecular weight 420.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(E)-[3-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]benzamide
Also Known As: 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide, AH-487/40686679, 3-chloro-N-[(E)-[3-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]benzamide, 3-chloro-N'-{(E)-[3-(2-cyano-4-nitrophenoxy)phenyl]methylidene}benzohydrazide
| Molecular Formula | C21H13ClN4O4 |
|---|---|
| Molecular Weight | 420.06 g/mol |
| LogP | 4.67608 |
| Topological Polar Surface Area | 117.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.06253 |
| Heavy Atoms | 30 |
| Complexity | 1187.619 |
Chemical Identifiers
| CAS Number | 634592-73-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C#N)/C=N/NC(=O)C3=CC(=CC=C3)Cl |
Product Overview
3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide (CAS 634592-73-7), with molecular formula C21H13ClN4O4 and molecular weight 420.06 g/mol. IUPAC: 3-chloro-N-[(E)-[3-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]benzamide.
Chemical Property Profile of 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide
Property Insights of 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide
The XLogP value of 4.67608 indicates that 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide. Following Lipinski's Rule of Five, 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide has 1 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 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide?
The CAS number of 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide is 634592-73-7.
What is the molecular formula of 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide?
The molecular formula of 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide is C21H13ClN4O4.
What is the molecular weight of 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide?
The molecular weight of 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide is 420.06 g/mol.
Where can I buy 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide?
You can request a quote for 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N'-(3-{2-cyano-4-nitrophenoxy}benzylidene)benzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.