2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate
TL;DR: 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate (CAS 7196-10-3) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate
Also Known As: 2-(diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate, 2-diethylaminoethyl 3-methylbenzofuran-2-carboxylate, 2-diethylaminoethyl 3-methyl-1-benzofuran-2-carboxylate
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 42.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 7196-10-3 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=C(C2=CC=CC=C2O1)C |
| InChIKey | JZFWTZVHIUWKCI-UHFFFAOYSA-N |
Product Overview
2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate (CAS 7196-10-3), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: 2-(diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate.
Chemical Property Profile of 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate
Property Insights of 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate
The XLogP value of 3.6 indicates that 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.7 Ų, 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate has 0 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-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate?
The CAS number of 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate is 7196-10-3.
What is the molecular formula of 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate?
The molecular formula of 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate is C16H21NO3.
What is the molecular weight of 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate?
The molecular weight of 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate is 275.15 g/mol.
Where can I buy 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate?
You can request a quote for 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diethylamino)ethyl 3-methyl-1-benzofuran-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.