![4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one structure](/static/products/392/392739-44-5.png)
4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one
TL;DR: 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one (CAS 392739-44-5) is a chemical compound with molecular formula C16H12N2O5 and molecular weight 312.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-hydroxy-N-methylanilino)-3-nitrochromen-2-one
Also Known As: 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one, 4-(4-hydroxy-N-methylanilino)-3-nitrochromen-2-one, 4-[(4-hydroxyphenyl)methylamino]-3-nitrochromen-2-one, 4-[(4-hydroxyphenyl)-methyl-amino]-3-nitro-chromen-2-one
| Molecular Formula | C16H12N2O5 |
|---|---|
| Molecular Weight | 312.07 g/mol |
| LogP | 3.1747 |
| Topological Polar Surface Area | 96.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.07462 |
| Heavy Atoms | 23 |
| Complexity | 946.837 |
Chemical Identifiers
| CAS Number | 392739-44-5 |
|---|---|
| SMILES | CN(C1=CC=C(C=C1)O)C2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-] |
Product Overview
4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one (CAS 392739-44-5), with molecular formula C16H12N2O5 and molecular weight 312.07 g/mol. IUPAC: 4-(4-hydroxy-N-methylanilino)-3-nitrochromen-2-one.
Chemical Property Profile of 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one
Property Insights of 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one
The XLogP value of 3.1747 indicates that 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one. Following Lipinski's Rule of Five, 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one 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 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one?
The CAS number of 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one is 392739-44-5.
What is the molecular formula of 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one?
The molecular formula of 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one is C16H12N2O5.
What is the molecular weight of 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one?
The molecular weight of 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one is 312.07 g/mol.
Where can I buy 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one?
You can request a quote for 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-hydroxyphenyl)(methyl)amino]-3-nitro-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.