6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride
TL;DR: 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride (CAS 7696-50-6) is a chemical compound with molecular formula C8H13ClN2S and molecular weight 204.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine;hydrochloride
Also Known As: 5-Aminonicotinic acid, 6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride, 6-Methyl-4,5,6,7-tetrahydro-benzothiazol-2-ylamine hydrochloride, 6-Methyl-4,5,6,7-tetrahydrobenzo[d]thiazol-2(3h)-imine hydrochloride, 6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine;hydrochloride
| Molecular Formula | C8H13ClN2S |
|---|---|
| Molecular Weight | 204.05 g/mol |
| LogP | 2.2719 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.0488 |
| Heavy Atoms | 12 |
| Complexity | 272.0216 |
Chemical Identifiers
| CAS Number | 7696-50-6 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=N2)N.Cl |
Product Overview
6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride (CAS 7696-50-6), with molecular formula C8H13ClN2S and molecular weight 204.05 g/mol. IUPAC: 6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine;hydrochloride.
Chemical Property Profile of 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride
Property Insights of 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride
The XLogP value of 2.2719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride. With a topological polar surface area (TPSA) of 38.91 Ų, 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride 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 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride?
The CAS number of 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride is 7696-50-6.
What is the molecular formula of 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride?
The molecular formula of 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride is C8H13ClN2S.
What is the molecular weight of 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride?
The molecular weight of 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride is 204.05 g/mol.
Where can I buy 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride?
You can request a quote for 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.