1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine
TL;DR: 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine (CAS 642929-73-5) is a chemical compound with molecular formula C9H14N2S and molecular weight 182.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamine
Also Known As: 1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamine, 1-(4,5,6,7-Tetrahydrobenzo[d]thiazol-2-yl)ethanamine, 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethan-1-amine, 1-(4,5,6,7-tetrahydrobenzothiazol-2-yl)ethanamine, [1-(4,5,6,7-TETRAHYDRO-1,3-BENZOTHIAZOL-2-YL)-ETHYL]AMINE DIHYDROCHLORIDE
| Molecular Formula | C9H14N2S |
|---|---|
| Molecular Weight | 182.09 g/mol |
| LogP | 2.0416 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.08777 |
| Heavy Atoms | 12 |
| Complexity | 254.55594 |
Chemical Identifiers
| CAS Number | 642929-73-5 |
|---|---|
| SMILES | CC(C1=NC2=C(S1)CCCC2)N |
Product Overview
1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine (CAS 642929-73-5), with molecular formula C9H14N2S and molecular weight 182.09 g/mol. IUPAC: 1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanamine.
Chemical Property Profile of 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine
Property Insights of 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine
The XLogP value of 2.0416 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine. With a topological polar surface area (TPSA) of 38.91 Ų, 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine has 1 hydrogen bond donor(s) and 3 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 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine?
The CAS number of 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine is 642929-73-5.
What is the molecular formula of 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine?
The molecular formula of 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine is C9H14N2S.
What is the molecular weight of 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine?
The molecular weight of 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine is 182.09 g/mol.
Where can I buy 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine?
You can request a quote for 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,5,6,7-Tetrahydro-1,3-benzothiazol-2-yl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.