![7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one structure](/static/products/117/1178090-52-2.png)
7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one
TL;DR: 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one (CAS 1178090-52-2) is a chemical compound with molecular formula C20H22N2O3 and molecular weight 338.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-7-[[butyl(methyl)amino]methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)-1-benzofuran-3-one
Also Known As: 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one, 7-[(butylmethylamino)methyl]-6-hydroxy-2-(3-pyridylmethylene)benzo[b]furan-3-o ne, (2Z)-7-[[butyl(methyl)amino]methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)-1-benzofuran-3-one, (2Z)-7-{[butyl(methyl)amino]methyl}-6-hydroxy-2-(pyridin-3-ylmethylidene)-1-benzofuran-3(2H)-one, (Z)-7-((butyl(methyl)amino)methyl)-6-hydroxy-2-(pyridin-3-ylmethylene)benzofuran-3(2H)-one
| Molecular Formula | C20H22N2O3 |
|---|---|
| Molecular Weight | 338.16 g/mol |
| LogP | 3.6353 |
| Topological Polar Surface Area | 62.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.16306 |
| Heavy Atoms | 25 |
| Complexity | 800.0886 |
Chemical Identifiers
| CAS Number | 1178090-52-2 |
|---|---|
| SMILES | CCCCN(C)CC1=C(C=CC2=C1O/C(=C\C3=CN=CC=C3)/C2=O)O |
Product Overview
7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one (CAS 1178090-52-2), with molecular formula C20H22N2O3 and molecular weight 338.16 g/mol. IUPAC: (2Z)-7-[[butyl(methyl)amino]methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)-1-benzofuran-3-one.
Chemical Property Profile of 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one
Property Insights of 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one
The XLogP value of 3.6353 indicates that 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one. Following Lipinski's Rule of Five, 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one has 1 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 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one?
The CAS number of 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one is 1178090-52-2.
What is the molecular formula of 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one?
The molecular formula of 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one is C20H22N2O3.
What is the molecular weight of 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one?
The molecular weight of 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one is 338.16 g/mol.
Where can I buy 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one?
You can request a quote for 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one?
Yes, KEHONG BIO provides custom synthesis services for 7-[(butyl-methyl-amino)methyl]-6-hydroxy-2-(pyridin-3-ylmethylidene)benzofuran-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.