4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-
TL;DR: 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)- (CAS 78431-35-3) is a chemical compound with molecular formula C17H13NO5 and molecular weight 311.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-7-methoxy-3-[(4-nitrophenyl)methylidene]chromen-4-one
Also Known As: 4-18-00-00736 (Beilstein Handbook Reference), 2,3-Dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-4H-1-benzopyran-4-one, 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-, (3Z)-7-methoxy-3-[(4-nitrophenyl)methylidene]chromen-4-one, RefChem:1071836
| Molecular Formula | C17H13NO5 |
|---|---|
| Molecular Weight | 311.08 g/mol |
| LogP | 3.2621 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.07938 |
| Heavy Atoms | 23 |
| Complexity | 808.23346 |
Chemical Identifiers
| CAS Number | 78431-35-3 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=O)/C(=C\C3=CC=C(C=C3)[N+](=O)[O-])/CO2 |
Product Overview
4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)- (CAS 78431-35-3), with molecular formula C17H13NO5 and molecular weight 311.08 g/mol. IUPAC: (3Z)-7-methoxy-3-[(4-nitrophenyl)methylidene]chromen-4-one.
Chemical Property Profile of 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-
Property Insights of 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-
The XLogP value of 3.2621 indicates that 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-. Following Lipinski's Rule of Five, 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)- has 0 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 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-?
The CAS number of 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)- is 78431-35-3.
What is the molecular formula of 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-?
The molecular formula of 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)- is C17H13NO5.
What is the molecular weight of 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-?
The molecular weight of 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)- is 311.08 g/mol.
Where can I buy 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-?
You can request a quote for 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1-Benzopyran-4-one, 2,3-dihydro-7-methoxy-3-((4-nitrophenyl)methylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.