Benzo(b)thiophene-3-ethylamine, N-methyl-
TL;DR: Benzo(b)thiophene-3-ethylamine, N-methyl- (CAS 52994-61-3) is a chemical compound with molecular formula C11H13NS and molecular weight 191.07687 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1-benzothiophen-3-yl)-N-methylethanamine
Also Known As: N-Methylbenzo(b)thiophene-3-ethylamine, 3-(2-(Methylamino)ethyl)benzo(b)thiophene, BENZO(b)THIOPHENE-3-ETHYLAMINE, N-METHYL-, [2-(1-benzothiophen-3-yl)ethyl](methyl)amine, Benzo[b]thiophene-3-ethanamine, N-methyl-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H13NS |
| Molecular Weight | 191.07687 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 40.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.07687 Da |
| Heavy Atoms | 13 |
| Complexity | 160.0 |
| SMILES | CNCCC1=CSC2=CC=CC=C21 |
| InChIKey | UWWLQUATUMACJU-UHFFFAOYSA-N |
Chemical Property Profile of Benzo(b)thiophene-3-ethylamine, N-methyl-
Property Insights of Benzo(b)thiophene-3-ethylamine, N-methyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo(b)thiophene-3-ethylamine, N-methyl-. With a topological polar surface area (TPSA) of 40.3 Ų, Benzo(b)thiophene-3-ethylamine, N-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(b)thiophene-3-ethylamine, N-methyl- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzo(b)thiophene-3-ethylamine, N-methyl-?
The CAS number of Benzo(b)thiophene-3-ethylamine, N-methyl- is 52994-61-3.
What is the molecular formula of Benzo(b)thiophene-3-ethylamine, N-methyl-?
The molecular formula of Benzo(b)thiophene-3-ethylamine, N-methyl- is C11H13NS.
What is the molecular weight of Benzo(b)thiophene-3-ethylamine, N-methyl-?
The molecular weight of Benzo(b)thiophene-3-ethylamine, N-methyl- is 191.07687 g/mol.
Where can I buy Benzo(b)thiophene-3-ethylamine, N-methyl-?
You can request a quote for Benzo(b)thiophene-3-ethylamine, N-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzo(b)thiophene-3-ethylamine, N-methyl-?
Yes, CoreyChem provides custom synthesis services for Benzo(b)thiophene-3-ethylamine, N-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.