2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate
TL;DR: 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate (CAS 15272-63-6) is a chemical compound with molecular formula C15H19NO2S and molecular weight 277.11365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(diethylamino)ethyl 1-benzothiophene-2-carboxylate
Also Known As: 2-(diethylamino)ethyl 1-benzothiophene-2-carboxylate, 2-diethylaminoethyl 1-benzothiophene-2-carboxylate, Benzo[b]thiophene-2-carboxylicacid, 2-(diethylamino)ethyl ester, 2(1H)-Pyrazinone,1-hydroxy-6-(1-hydroxy-1-methylethyl)-3-(2-methylpropyl)-(9CI)
Technical Specifications
| Molecular Formula | C15H19NO2S |
| Molecular Weight | 277.11365 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 57.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 277.11365 Da |
| Heavy Atoms | 19 |
| Complexity | 294.0 |
| SMILES | CCN(CC)CCOC(=O)C1=CC2=CC=CC=C2S1 |
| InChIKey | KPBDAAXIAFMDTQ-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate
Property Insights of 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate
The XLogP value of 3.9 indicates that 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.8 Ų, 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diethylamino)ethyl 1-benzothiophene-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
What is the CAS number of 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate?
The CAS number of 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate is 15272-63-6.
What is the molecular formula of 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate?
The molecular formula of 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate is C15H19NO2S.
What is the molecular weight of 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate?
The molecular weight of 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate is 277.11365 g/mol.
Where can I buy 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate?
You can request a quote for 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for 2-(Diethylamino)ethyl 1-benzothiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.