4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one
TL;DR: 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one (CAS 859142-24-8) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[butyl(methyl)amino]methyl]-6-hydroxy-7-methylchromen-2-one
Also Known As: 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one, AB01288935-01, 4-[[butyl(methyl)amino]methyl]-6-hydroxy-7-methylchromen-2-one, F3385-1888, 4-[(butyl-methyl-amino)methyl]-6-hydroxy-7-methyl-chromen-2-one
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 3.03892 |
| Topological Polar Surface Area | 53.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 660.55493 |
Chemical Identifiers
| CAS Number | 859142-24-8 |
|---|---|
| SMILES | CCCCN(C)CC1=CC(=O)OC2=C1C=C(C(=C2)C)O |
Product Overview
4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one (CAS 859142-24-8), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: 4-[[butyl(methyl)amino]methyl]-6-hydroxy-7-methylchromen-2-one.
Chemical Property Profile of 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one
Property Insights of 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one
The XLogP value of 3.03892 indicates that 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-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 53.68 Ų, 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-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 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one?
The CAS number of 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one is 859142-24-8.
What is the molecular formula of 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one?
The molecular formula of 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one is C16H21NO3.
What is the molecular weight of 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one?
The molecular weight of 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one is 275.15 g/mol.
Where can I buy 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one?
You can request a quote for 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-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 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-((butyl(methyl)amino)methyl)-6-hydroxy-7-methyl-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.