4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide
TL;DR: 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide (CAS 328921-50-2) is a chemical compound with molecular formula C16H17N3O4 and molecular weight 315.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzamide
Also Known As: 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide, 4-tert-butyl-N'-[(E)-(5-nitrofuran-2-yl)methylidene]benzohydrazide, 4-tert-butyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzamide, N-[(1E)-2-(5-nitro(2-furyl))-1-azavinyl][4-(tert-butyl)phenyl]carboxamide
| Molecular Formula | C16H17N3O4 |
|---|---|
| Molecular Weight | 315.12 g/mol |
| LogP | 3.2492 |
| Topological Polar Surface Area | 97.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.12192 |
| Heavy Atoms | 23 |
| Complexity | 739.43097 |
Chemical Identifiers
| CAS Number | 328921-50-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-] |
Product Overview
4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide (CAS 328921-50-2), with molecular formula C16H17N3O4 and molecular weight 315.12 g/mol. IUPAC: 4-tert-butyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzamide.
Chemical Property Profile of 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide
Property Insights of 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide
The XLogP value of 3.2492 indicates that 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide. Following Lipinski's Rule of Five, 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide 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 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide?
The CAS number of 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide is 328921-50-2.
What is the molecular formula of 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide?
The molecular formula of 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide is C16H17N3O4.
What is the molecular weight of 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide?
The molecular weight of 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide is 315.12 g/mol.
Where can I buy 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide?
You can request a quote for 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-butyl-N'-[(5-nitrofuran-2-yl)methylidene]benzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.