![3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one structure](/static/products/7906/790683-49-7.webp)
3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one
TL;DR: 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one (CAS 790683-49-7) is a chemical compound with molecular formula C16H10ClNO4 and molecular weight 315.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-3-[(4-chloro-3-nitrophenyl)methylidene]chromen-4-one
Also Known As: 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one, (3E)-3-[(4-chloro-3-nitrophenyl)methylidene]-3,4-dihydro-2H-1-benzopyran-4-one, (3E)-3-[(4-chloro-3-nitrophenyl)methylidene]chromen-4-one, AB00728683-01, 1W-0670
| Molecular Formula | C16H10ClNO4 |
|---|---|
| Molecular Weight | 315.03 g/mol |
| LogP | 3.9069 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.02985 |
| Heavy Atoms | 22 |
| Complexity | 813.54315 |
Chemical Identifiers
| CAS Number | 790683-49-7 |
|---|---|
| SMILES | C1/C(=C\C2=CC(=C(C=C2)Cl)[N+](=O)[O-])/C(=O)C3=CC=CC=C3O1 |
Product Overview
3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one (CAS 790683-49-7), with molecular formula C16H10ClNO4 and molecular weight 315.03 g/mol. IUPAC: (3E)-3-[(4-chloro-3-nitrophenyl)methylidene]chromen-4-one.
Chemical Property Profile of 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one
Property Insights of 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one
The XLogP value of 3.9069 indicates that 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one. Following Lipinski's Rule of Five, 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one has 0 hydrogen bond donor(s) and 4 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-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one?
The CAS number of 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one is 790683-49-7.
What is the molecular formula of 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one?
The molecular formula of 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one is C16H10ClNO4.
What is the molecular weight of 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one?
The molecular weight of 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one is 315.03 g/mol.
Where can I buy 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one?
You can request a quote for 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(E)-(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.