3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester
TL;DR: 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester (CAS 1052222-23-7) is a chemical compound with molecular formula C16H20ClNO4 and molecular weight 325.1081 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-(morpholin-4-ylmethyl)-1-benzofuran-2-carboxylate;hydrochloride
Also Known As: 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester, ethyl 3-(morpholinomethyl)benzofuran-2-carboxylate hydrochloride, ethyl 3-(morpholin-4-ylmethyl)benzo[d]furan-2-carboxylate, chloride, ethyl 3-(morpholin-4-ylmethyl)-1-benzofuran-2-carboxylate hydrochloride
Technical Specifications
| Molecular Formula | C16H20ClNO4 |
| Molecular Weight | 325.1081 g/mol |
| XLogP | 2.8635 |
| Topological Polar Surface Area (TPSA) | 51.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.1081 Da |
| Heavy Atoms | 22 |
| Complexity | 356.0 |
| SMILES | CCOC(=O)C1=C(C2=CC=CC=C2O1)CN3CCOCC3.Cl |
| InChIKey | GGQGQTYOYZWXLH-UHFFFAOYSA-N |
Chemical Property Profile of 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester
Property Insights of 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester
The XLogP value of 2.8635 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester. With a topological polar surface area (TPSA) of 51.9 Ų, 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester?
The CAS number of 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester is 1052222-23-7.
What is the molecular formula of 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester?
The molecular formula of 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester is C16H20ClNO4.
What is the molecular weight of 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester?
The molecular weight of 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester is 325.1081 g/mol.
Where can I buy 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester?
You can request a quote for 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester?
Yes, CoreyChem provides custom synthesis services for 3-Morpholin-4-ylmethyl-benzofuran-2-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.