Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate
TL;DR: Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate (CAS 107972-99-6) is a chemical compound with molecular formula C8H10ClN3O2 and molecular weight 215.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-chloro-6-(dimethylamino)pyrimidine-4-carboxylate
Also Known As: Methyl 2-chloro-6-dimethylamino-pyrimidine-4-carboxylate, Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate, methyl 2-chloro-6-(dimethylamino)pyrimidine-4-carboxylate
| Molecular Formula | C8H10ClN3O2 |
|---|---|
| Molecular Weight | 215.05 g/mol |
| LogP | 0.9826 |
| Topological Polar Surface Area | 55.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.04616 |
| Heavy Atoms | 14 |
| Complexity | 354.43967 |
Chemical Identifiers
| CAS Number | 107972-99-6 |
|---|---|
| SMILES | CN(C)C1=NC(=NC(=C1)C(=O)OC)Cl |
Product Overview
Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate (CAS 107972-99-6), with molecular formula C8H10ClN3O2 and molecular weight 215.05 g/mol. IUPAC: methyl 2-chloro-6-(dimethylamino)pyrimidine-4-carboxylate.
Chemical Property Profile of Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate
Property Insights of Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate
The XLogP value of 0.9826 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate. With a topological polar surface area (TPSA) of 55.32 Ų, Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate has 0 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 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate?
The CAS number of Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate is 107972-99-6.
What is the molecular formula of Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate?
The molecular formula of Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate is C8H10ClN3O2.
What is the molecular weight of Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate?
The molecular weight of Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate is 215.05 g/mol.
Where can I buy Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate?
You can request a quote for Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-chloro-6-(dimethylamino)-4-pyrimidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.