Methyl 3-Amino-2,6-dichloroisonicotinate
TL;DR: Methyl 3-Amino-2,6-dichloroisonicotinate (CAS 458543-81-2) is a chemical compound with molecular formula C7H6Cl2N2O2 and molecular weight 219.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-amino-2,6-dichloropyridine-4-carboxylate
Also Known As: Methyl 3-Amino-2,6-dichloroisonicotinate, methyl 3-amino-2,6-dichloropyridine-4-carboxylate, Methyl3-amino-2,6-dichloroisonicotinate, 3-Amino-2,6-dichloropyridine-4-carboxylic acid methyl ester, 3-Amino-2,6-dichloro-isonicotinic acid methyl ester
| Molecular Formula | C7H6Cl2N2O2 |
|---|---|
| Molecular Weight | 219.98 g/mol |
| LogP | 1.7572 |
| Topological Polar Surface Area | 65.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 219.98064 |
| Heavy Atoms | 13 |
| Complexity | 354.59094 |
Chemical Identifiers
| CAS Number | 458543-81-2 |
|---|---|
| SMILES | COC(=O)C1=CC(=NC(=C1N)Cl)Cl |
Product Overview
Methyl 3-Amino-2,6-dichloroisonicotinate (CAS 458543-81-2), with molecular formula C7H6Cl2N2O2 and molecular weight 219.98 g/mol. IUPAC: methyl 3-amino-2,6-dichloropyridine-4-carboxylate.
Chemical Property Profile of Methyl 3-Amino-2,6-dichloroisonicotinate
Property Insights of Methyl 3-Amino-2,6-dichloroisonicotinate
The XLogP value of 1.7572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-Amino-2,6-dichloroisonicotinate. The TPSA of 65.21 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-Amino-2,6-dichloroisonicotinate. Following Lipinski's Rule of Five, Methyl 3-Amino-2,6-dichloroisonicotinate 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 Methyl 3-Amino-2,6-dichloroisonicotinate?
The CAS number of Methyl 3-Amino-2,6-dichloroisonicotinate is 458543-81-2.
What is the molecular formula of Methyl 3-Amino-2,6-dichloroisonicotinate?
The molecular formula of Methyl 3-Amino-2,6-dichloroisonicotinate is C7H6Cl2N2O2.
What is the molecular weight of Methyl 3-Amino-2,6-dichloroisonicotinate?
The molecular weight of Methyl 3-Amino-2,6-dichloroisonicotinate is 219.98 g/mol.
Where can I buy Methyl 3-Amino-2,6-dichloroisonicotinate?
You can request a quote for Methyl 3-Amino-2,6-dichloroisonicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-Amino-2,6-dichloroisonicotinate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-Amino-2,6-dichloroisonicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.