![N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine structure](/static/products/893/893597-74-5.png)
N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
TL;DR: N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine (CAS 893597-74-5) is a chemical compound with molecular formula C11H14BrN5S and molecular weight 327.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-bromophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
Also Known As: AN-465/42833689, N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine, N-[(3-bromophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine, (3-Bromo-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine, N-(3-bromobenzyl)-N-{2-[(1-methyl-1H-tetraazol-5-yl)sulfanyl]ethyl}amine
| Molecular Formula | C11H14BrN5S |
|---|---|
| Molecular Weight | 327.02 g/mol |
| LogP | 1.8545 |
| Topological Polar Surface Area | 55.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.01532 |
| Heavy Atoms | 18 |
| Complexity | 501.68372 |
Chemical Identifiers
| CAS Number | 893597-74-5 |
|---|---|
| SMILES | CN1C(=NN=N1)SCCNCC2=CC(=CC=C2)Br |
Product Overview
N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine (CAS 893597-74-5), with molecular formula C11H14BrN5S and molecular weight 327.02 g/mol. IUPAC: N-[(3-bromophenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine.
Chemical Property Profile of N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
Property Insights of N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
The XLogP value of 1.8545 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine. With a topological polar surface area (TPSA) of 55.63 Ų, N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine has 1 hydrogen bond donor(s) and 5 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 N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
The CAS number of N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine is 893597-74-5.
What is the molecular formula of N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
The molecular formula of N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine is C11H14BrN5S.
What is the molecular weight of N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
The molecular weight of N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine is 327.02 g/mol.
Where can I buy N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
You can request a quote for N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromobenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.