{[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate
TL;DR: {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate (CAS 938575-90-7) is a chemical compound with molecular formula C16H15BrN2O4 and molecular weight 378.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl] 5-bromopyridine-3-carboxylate
Also Known As: {[(3-methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate, 2-((3-methoxybenzyl)amino)-2-oxoethyl 5-bromonicotinate, F6609-1886, [2-[(3-methoxyphenyl)methylamino]-2-oxoethyl] 5-bromopyridine-3-carboxylate, 2-[(3-methoxybenzyl)amino]-2-oxoethyl 5-bromopyridine-3-carboxylate
| Molecular Formula | C16H15BrN2O4 |
|---|---|
| Molecular Weight | 378.02 g/mol |
| LogP | 2.3259 |
| Topological Polar Surface Area | 77.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.0215 |
| Heavy Atoms | 23 |
| Complexity | 705.9845 |
Chemical Identifiers
| CAS Number | 938575-90-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CNC(=O)COC(=O)C2=CC(=CN=C2)Br |
Product Overview
{[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate (CAS 938575-90-7), with molecular formula C16H15BrN2O4 and molecular weight 378.02 g/mol. IUPAC: [2-[(3-methoxyphenyl)methylamino]-2-oxoethyl] 5-bromopyridine-3-carboxylate.
Chemical Property Profile of {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate
Property Insights of {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate
The XLogP value of 2.3259 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate. The TPSA of 77.52 Ų falls within the moderate polarity range, balancing permeability and solubility for {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate. Following Lipinski's Rule of Five, {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-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 {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate?
The CAS number of {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate is 938575-90-7.
What is the molecular formula of {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate?
The molecular formula of {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate is C16H15BrN2O4.
What is the molecular weight of {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate?
The molecular weight of {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate is 378.02 g/mol.
Where can I buy {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate?
You can request a quote for {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for {[(3-Methoxyphenyl)methyl]carbamoyl}methyl 5-bromopyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.