N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide
TL;DR: N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide (CAS 360057-06-3) is a chemical compound with molecular formula C18H17ClN4O4 and molecular weight 388.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[4-(benzylamino)-4-oxobutan-2-ylidene]amino]-3-chloro-4-nitrobenzamide
Also Known As: N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide, N-[(E)-[4-(benzylamino)-4-oxobutan-2-ylidene]amino]-3-chloro-4-nitrobenzamide
| Molecular Formula | C18H17ClN4O4 |
|---|---|
| Molecular Weight | 388.09 g/mol |
| LogP | 3.0604 |
| Topological Polar Surface Area | 113.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 388.09384 |
| Heavy Atoms | 27 |
| Complexity | 884.1853 |
Chemical Identifiers
| CAS Number | 360057-06-3 |
|---|---|
| SMILES | C/C(=N\NC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])Cl)/CC(=O)NCC2=CC=CC=C2 |
Product Overview
N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide (CAS 360057-06-3), with molecular formula C18H17ClN4O4 and molecular weight 388.09 g/mol. IUPAC: N-[(E)-[4-(benzylamino)-4-oxobutan-2-ylidene]amino]-3-chloro-4-nitrobenzamide.
Chemical Property Profile of N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide
Property Insights of N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide
The XLogP value of 3.0604 indicates that N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide. Following Lipinski's Rule of Five, N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide has 2 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-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide?
The CAS number of N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide is 360057-06-3.
What is the molecular formula of N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide?
The molecular formula of N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide is C18H17ClN4O4.
What is the molecular weight of N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide?
The molecular weight of N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide is 388.09 g/mol.
Where can I buy N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide?
You can request a quote for N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide 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-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-3-({3-chloro-4-nitrobenzoyl}hydrazono)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.