Dimethyl 2-(5-amino-2-pyridinyl)malonate
TL;DR: Dimethyl 2-(5-amino-2-pyridinyl)malonate (CAS 860650-20-0) is a chemical compound with molecular formula C10H12N2O4 and molecular weight 224.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(5-amino-2-pyridinyl)propanedioate
Also Known As: 1,3-dimethyl 2-(5-aminopyridin-2-yl)propanedioate, dimethyl 2-(5-amino-2-pyridinyl)malonate, dimethyl 2-(5-aminopyridin-2-yl)propanedioate, dimethyl 2-(5-amino-2-pyridyl)propanedioate, 1,3-dimethyl2-(5-aminopyridin-2-yl)propanedioate
| Molecular Formula | C10H12N2O4 |
|---|---|
| Molecular Weight | 224.08 g/mol |
| LogP | 0.0934 |
| Topological Polar Surface Area | 91.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.07971 |
| Heavy Atoms | 16 |
| Complexity | 372.31042 |
Chemical Identifiers
| CAS Number | 860650-20-0 |
|---|---|
| SMILES | COC(=O)C(C1=NC=C(C=C1)N)C(=O)OC |
Product Overview
Dimethyl 2-(5-amino-2-pyridinyl)malonate (CAS 860650-20-0), with molecular formula C10H12N2O4 and molecular weight 224.08 g/mol. IUPAC: dimethyl 2-(5-amino-2-pyridinyl)propanedioate.
Chemical Property Profile of Dimethyl 2-(5-amino-2-pyridinyl)malonate
Property Insights of Dimethyl 2-(5-amino-2-pyridinyl)malonate
The XLogP value of 0.0934 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2-(5-amino-2-pyridinyl)malonate. The TPSA of 91.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-(5-amino-2-pyridinyl)malonate. Following Lipinski's Rule of Five, Dimethyl 2-(5-amino-2-pyridinyl)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 Dimethyl 2-(5-amino-2-pyridinyl)malonate?
The CAS number of Dimethyl 2-(5-amino-2-pyridinyl)malonate is 860650-20-0.
What is the molecular formula of Dimethyl 2-(5-amino-2-pyridinyl)malonate?
The molecular formula of Dimethyl 2-(5-amino-2-pyridinyl)malonate is C10H12N2O4.
What is the molecular weight of Dimethyl 2-(5-amino-2-pyridinyl)malonate?
The molecular weight of Dimethyl 2-(5-amino-2-pyridinyl)malonate is 224.08 g/mol.
Where can I buy Dimethyl 2-(5-amino-2-pyridinyl)malonate?
You can request a quote for Dimethyl 2-(5-amino-2-pyridinyl)malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-(5-amino-2-pyridinyl)malonate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-(5-amino-2-pyridinyl)malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.