Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester
TL;DR: Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester (CAS 1164480-79-8) is a chemical compound with molecular formula C14H18ClNO3 and molecular weight 283.09753 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(dimethylamino)propyl 1-benzofuran-2-carboxylate;hydrochloride
Also Known As: Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester, 3-(dimethylamino)propyl benzofuran-2-carboxylate hydrochloride, 3-(dimethylamino)propyl 1-benzofuran-2-carboxylate hydrochloride
Technical Specifications
| Molecular Formula | C14H18ClNO3 |
| Molecular Weight | 283.09753 g/mol |
| XLogP | 2.9631 |
| Topological Polar Surface Area (TPSA) | 42.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 283.09753 Da |
| Heavy Atoms | 19 |
| Complexity | 280.0 |
| SMILES | CN(C)CCCOC(=O)C1=CC2=CC=CC=C2O1.Cl |
| InChIKey | MRXXEECDFKJVHZ-UHFFFAOYSA-N |
Chemical Property Profile of Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester
Property Insights of Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester
The XLogP value of 2.9631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester. With a topological polar surface area (TPSA) of 42.7 Ų, Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester 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
What is the CAS number of Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester?
The CAS number of Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester is 1164480-79-8.
What is the molecular formula of Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester?
The molecular formula of Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester is C14H18ClNO3.
What is the molecular weight of Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester?
The molecular weight of Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester is 283.09753 g/mol.
Where can I buy Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester?
You can request a quote for Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester?
Yes, CoreyChem provides custom synthesis services for Benzofuran-2-carboxylic acid 3-dimethylamino-propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.