![Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate structure](/static/products/1325/13250-95-8.webp)
Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate
TL;DR: Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate (CAS 13250-95-8) is a chemical compound with molecular formula C14H18N2O4 and molecular weight 278.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[(6-methyl-2-pyridinyl)amino]methylidene]propanedioate
Also Known As: Diethyl (6-methyl-2-pyridylaminomethylene)malonate, diethyl 2-[[(6-methylpyridin-2-yl)amino]methylidene]propanedioate, BAS 00440723, Diethyl (((6-methyl-2-pyridyl)amino)methylene)malonate, DIETHYL [[(6-METHYL-2-PYRIDYL)AMINO]METHYLENE]MALONATE
| Molecular Formula | C14H18N2O4 |
|---|---|
| Molecular Weight | 278.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 77.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 278.12665 |
| Heavy Atoms | 20 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 13250-95-8 |
|---|---|
| SMILES | CCOC(=O)C(=CNC1=CC=CC(=N1)C)C(=O)OCC |
| InChIKey | IAXFBMUDERBERN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate (CAS 13250-95-8), with molecular formula C14H18N2O4 and molecular weight 278.13 g/mol. IUPAC: diethyl 2-[[(6-methyl-2-pyridinyl)amino]methylidene]propanedioate.
Chemical Property Profile of Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate
Property Insights of Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate. Following Lipinski's Rule of Five, Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate 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 Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate?
The CAS number of Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate is 13250-95-8.
What is the molecular formula of Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate?
The molecular formula of Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate is C14H18N2O4.
What is the molecular weight of Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate?
The molecular weight of Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate is 278.13 g/mol.
Where can I buy Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate?
You can request a quote for Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl [[(6-methyl-2-pyridyl)amino]methylene]malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.