(1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one
TL;DR: (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one (CAS 396104-65-7) is a chemical compound with molecular formula C21H20N2O4 and molecular weight 364.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2,4-dimethylphenyl)iminomethyl]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-ol
Also Known As: (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one, (1Z)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one, 1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one, 1-[[(2,4-dimethylphenyl)amino]methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one, (E)-1-(((2,4-dimethylphenyl)imino)methyl)-3-nitro-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ol
| Molecular Formula | C21H20N2O4 |
|---|---|
| Molecular Weight | 364.14 g/mol |
| LogP | 5.29284 |
| Topological Polar Surface Area | 88.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.1423 |
| Heavy Atoms | 27 |
| Complexity | 1095.4901 |
Chemical Identifiers
| CAS Number | 396104-65-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N=CC2=C(C(=CC3=C2C4=C(O3)CCCC4)[N+](=O)[O-])O)C |
Product Overview
(1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one (CAS 396104-65-7), with molecular formula C21H20N2O4 and molecular weight 364.14 g/mol. IUPAC: 1-[(2,4-dimethylphenyl)iminomethyl]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-ol.
Chemical Property Profile of (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one
Property Insights of (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one
The XLogP value of 5.29284 indicates that (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.87 Ų falls within the moderate polarity range, balancing permeability and solubility for (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one. Following Lipinski's Rule of Five, (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one?
The CAS number of (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one is 396104-65-7.
What is the molecular formula of (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one?
The molecular formula of (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one is C21H20N2O4.
What is the molecular weight of (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one?
The molecular weight of (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one is 364.14 g/mol.
Where can I buy (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one?
You can request a quote for (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one?
Yes, KEHONG BIO provides custom synthesis services for (1E)-1-[(2,4-dimethylanilino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.