(E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide
TL;DR: (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide (CAS 330673-49-9) is a chemical compound with molecular formula C17H16N4O5 and molecular weight 356.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dinitro-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]benzamide
Also Known As: (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide, 3,5-dinitro-N'-[(1E)-[4-(propan-2-yl)phenyl]methylidene]benzohydrazide, F0890-0562, 3,5-dinitro-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]benzamide, 3,5-dinitro-N'-{(E)-[4-(propan-2-yl)phenyl]methylidene}benzohydrazide
| Molecular Formula | C17H16N4O5 |
|---|---|
| Molecular Weight | 356.11 g/mol |
| LogP | 3.3903 |
| Topological Polar Surface Area | 127.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.11206 |
| Heavy Atoms | 26 |
| Complexity | 842.972 |
Chemical Identifiers
| CAS Number | 330673-49-9 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
(E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide (CAS 330673-49-9), with molecular formula C17H16N4O5 and molecular weight 356.11 g/mol. IUPAC: 3,5-dinitro-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]benzamide.
Chemical Property Profile of (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide
Property Insights of (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide
The XLogP value of 3.3903 indicates that (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.74 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide. Following Lipinski's Rule of Five, (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide 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 (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide?
The CAS number of (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide is 330673-49-9.
What is the molecular formula of (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide?
The molecular formula of (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide is C17H16N4O5.
What is the molecular weight of (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide?
The molecular weight of (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide is 356.11 g/mol.
Where can I buy (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide?
You can request a quote for (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(4-isopropylbenzylidene)-3,5-dinitrobenzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.