7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one
TL;DR: 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one (CAS 79344-52-8) is a chemical compound with molecular formula C18H17NO3 and molecular weight 295.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-4-[(4-methylanilino)methyl]chromen-2-one
Also Known As: 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one, 7-methoxy-4-((p-tolylamino)methyl)-2H-chromen-2-one, 7-methoxy-4-[(4-methylanilino)methyl]chromen-2-one, AB01272786-02, F3385-1623
| Molecular Formula | C18H17NO3 |
|---|---|
| Molecular Weight | 295.12 g/mol |
| LogP | 3.72212 |
| Topological Polar Surface Area | 51.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.12085 |
| Heavy Atoms | 22 |
| Complexity | 850.33044 |
Chemical Identifiers
| CAS Number | 79344-52-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCC2=CC(=O)OC3=C2C=CC(=C3)OC |
Product Overview
7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one (CAS 79344-52-8), with molecular formula C18H17NO3 and molecular weight 295.12 g/mol. IUPAC: 7-methoxy-4-[(4-methylanilino)methyl]chromen-2-one.
Chemical Property Profile of 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one
Property Insights of 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one
The XLogP value of 3.72212 indicates that 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.47 Ų, 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one has 1 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 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one?
The CAS number of 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one is 79344-52-8.
What is the molecular formula of 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one?
The molecular formula of 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one is C18H17NO3.
What is the molecular weight of 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one?
The molecular weight of 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one is 295.12 g/mol.
Where can I buy 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one?
You can request a quote for 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-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 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-methoxy-4-{[(4-methylphenyl)amino]methyl}-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.