2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate
TL;DR: 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate (CAS 1002663-56-0) is a chemical compound with molecular formula C13H17NO4 and molecular weight 251.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2-methoxyethylamino)-2-oxoethyl] 4-methylbenzoate
Also Known As: [(2-methoxyethyl)carbamoyl]methyl 4-methylbenzoate|[2-(2-methoxyethylamino)-2-oxoethyl] 4-methylbenzoate|2-((2-methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate|2-[(2-methoxyethyl)amino]-2-oxoethyl 4-methylbenzoate|F6609-1816
| Molecular Formula | C13H17NO4 |
|---|---|
| Molecular Weight | 251.12 g/mol |
| LogP | 0.91442 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 251.11575 |
| Heavy Atoms | 18 |
| Complexity | 399.9572 |
Chemical Identifiers
| CAS Number | 1002663-56-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OCC(=O)NCCOC |
Product Overview
2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate (CAS 1002663-56-0), with molecular formula C13H17NO4 and molecular weight 251.12 g/mol. IUPAC: [2-(2-methoxyethylamino)-2-oxoethyl] 4-methylbenzoate.
Chemical Property Profile of 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate
Property Insights of 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate
The XLogP value of 0.91442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate. Following Lipinski's Rule of Five, 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate 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 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate?
The CAS number of 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate is 1002663-56-0.
What is the molecular formula of 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate?
The molecular formula of 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate is C13H17NO4.
What is the molecular weight of 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate?
The molecular weight of 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate is 251.12 g/mol.
Where can I buy 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate?
You can request a quote for 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-Methoxyethyl)amino)-2-oxoethyl 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.