Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate
TL;DR: Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate (CAS 19143-23-8) 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-[[(4-methyl-2-pyridinyl)amino]methylidene]propanedioate
Also Known As: BTCPHCL, BAS 00440724, ((4-METHYL-2-PYRIDYLAMINO)METHYLIDENE)MALONIC ACID DIETHYL ESTER, diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate, diethyl 2-[[(4-methylpyridin-2-yl)amino]methylidene]propanedioate
| 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 | 19143-23-8 |
|---|---|
| SMILES | CCOC(=O)C(=CNC1=NC=CC(=C1)C)C(=O)OCC |
| InChIKey | YUYJTQOIHHNZBL-UHFFFAOYSA-N |
Product Overview
Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate (CAS 19143-23-8), with molecular formula C14H18N2O4 and molecular weight 278.13 g/mol. IUPAC: diethyl 2-[[(4-methyl-2-pyridinyl)amino]methylidene]propanedioate.
Chemical Property Profile of Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate
Property Insights of Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate. Following Lipinski's Rule of Five, Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate 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 {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate?
The CAS number of Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate is 19143-23-8.
What is the molecular formula of Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate?
The molecular formula of Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate is C14H18N2O4.
What is the molecular weight of Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate?
The molecular weight of Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate is 278.13 g/mol.
Where can I buy Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate?
You can request a quote for Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.