![(2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine structure](/static/products/104/1049697-78-0.png)
(2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine
TL;DR: (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine (CAS 1049697-78-0) is a chemical compound with molecular formula C13H20ClN5O2S and molecular weight 345.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,3-dimethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine;hydrochloride
Also Known As: (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine, N-(2,3-dimethoxybenzyl)-2-((1-methyl-1H-tetrazol-5-yl)thio)ethanamine hydrochloride, N-[(2,3-dimethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine hydrochloride
| Molecular Formula | C13H20ClN5O2S |
|---|---|
| Molecular Weight | 345.10 g/mol |
| LogP | 1.531 |
| Topological Polar Surface Area | 74.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 345.10263 |
| Heavy Atoms | 22 |
| Complexity | 581.3081 |
Chemical Identifiers
| CAS Number | 1049697-78-0 |
|---|---|
| SMILES | CN1C(=NN=N1)SCCNCC2=C(C(=CC=C2)OC)OC.Cl |
Product Overview
(2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine (CAS 1049697-78-0), with molecular formula C13H20ClN5O2S and molecular weight 345.10 g/mol. IUPAC: N-[(2,3-dimethoxyphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine;hydrochloride.
Chemical Property Profile of (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine
Property Insights of (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine
The XLogP value of 1.531 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine. The TPSA of 74.09 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine. Following Lipinski's Rule of Five, (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine has 1 hydrogen bond donor(s) and 7 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 (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine?
The CAS number of (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine is 1049697-78-0.
What is the molecular formula of (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine?
The molecular formula of (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine is C13H20ClN5O2S.
What is the molecular weight of (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine?
The molecular weight of (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine is 345.10 g/mol.
Where can I buy (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine?
You can request a quote for (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine?
Yes, KEHONG BIO provides custom synthesis services for (2,3-Dimethoxy-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.