(Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate
TL;DR: (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate (CAS 730253-69-7) is a chemical compound with molecular formula C9H9ClN2O3 and molecular weight 228.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(methylamino)-2-oxoethyl] 6-chloropyridine-3-carboxylate
Also Known As: (methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate, [2-(methylamino)-2-oxoethyl] 6-chloropyridine-3-carboxylate
| Molecular Formula | C9H9ClN2O3 |
|---|---|
| Molecular Weight | 228.03 g/mol |
| LogP | 0.6378 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.03017 |
| Heavy Atoms | 15 |
| Complexity | 364.12512 |
Chemical Identifiers
| CAS Number | 730253-69-7 |
|---|---|
| SMILES | CNC(=O)COC(=O)C1=CN=C(C=C1)Cl |
Product Overview
(Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate (CAS 730253-69-7), with molecular formula C9H9ClN2O3 and molecular weight 228.03 g/mol. IUPAC: [2-(methylamino)-2-oxoethyl] 6-chloropyridine-3-carboxylate.
Chemical Property Profile of (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate
Property Insights of (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate
The XLogP value of 0.6378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate 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 (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
The CAS number of (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate is 730253-69-7.
What is the molecular formula of (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
The molecular formula of (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate is C9H9ClN2O3.
What is the molecular weight of (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
The molecular weight of (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate is 228.03 g/mol.
Where can I buy (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
You can request a quote for (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (Methylcarbamoyl)methyl 6-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.