Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate
TL;DR: Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate (CAS 502184-51-2) is a chemical compound with molecular formula C6H5Cl2N3O2 and molecular weight 220.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate
Also Known As: methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate, 4-Pyrimidinecarboxylic acid der., 4CH-012189, methyl 5-amino-2,6-dichloro-pyrimidine-4-carboxylate, methyl5-amino-2,6-dichloropyrimidine-4-carboxylate
| Molecular Formula | C6H5Cl2N3O2 |
|---|---|
| Molecular Weight | 220.98 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.97588 |
| Heavy Atoms | 13 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 502184-51-2 |
|---|---|
| SMILES | COC(=O)C1=C(C(=NC(=N1)Cl)Cl)N |
| InChIKey | ZYKZBDOQIWZNNN-UHFFFAOYSA-N |
Product Overview
Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate (CAS 502184-51-2), with molecular formula C6H5Cl2N3O2 and molecular weight 220.98 g/mol. IUPAC: methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate.
Chemical Property Profile of Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate
Property Insights of Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate. Following Lipinski's Rule of Five, Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate 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 Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate?
The CAS number of Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate is 502184-51-2.
What is the molecular formula of Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate?
The molecular formula of Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate is C6H5Cl2N3O2.
What is the molecular weight of Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate?
The molecular weight of Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate is 220.98 g/mol.
Where can I buy Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate?
You can request a quote for Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-amino-2,6-dichloropyrimidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.