4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine
TL;DR: 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine (CAS 1050509-07-3) is a chemical compound with molecular formula C9H13NS and molecular weight 167.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethanamine
Also Known As: 4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethanamine, (4,5,6,7-Tetrahydro-1-benzothien-3-ylmethyl)amine hydrochloride, 4,5,6,7-Tetrahydrobenzothiophene-3-methanamine, (4,5,6,7-Tetrahydrobenzo[b]thiophen-3-yl)methanamine, (4,5,6,7-tetrahydro-1-benzothien-3-ylmethyl)amine
| Molecular Formula | C9H13NS |
|---|---|
| Molecular Weight | 167.08 g/mol |
| LogP | 2.0856 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 167.07687 |
| Heavy Atoms | 11 |
| Complexity | 238.56546 |
Chemical Identifiers
| CAS Number | 1050509-07-3 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=CS2)CN |
Product Overview
4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine (CAS 1050509-07-3), with molecular formula C9H13NS and molecular weight 167.08 g/mol. IUPAC: 4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethanamine.
Chemical Property Profile of 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine
Property Insights of 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine
The XLogP value of 2.0856 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine. With a topological polar surface area (TPSA) of 26.02 Ų, 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine 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
Frequently Asked Questions
What is the CAS number of 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine?
The CAS number of 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine is 1050509-07-3.
What is the molecular formula of 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine?
The molecular formula of 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine is C9H13NS.
What is the molecular weight of 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine?
The molecular weight of 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine is 167.08 g/mol.
Where can I buy 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine?
You can request a quote for 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6,7-Tetrahydro-1-benzothiophen-3-ylmethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.