![N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine structure](/static/products/880/880808-98-0.png)
N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
TL;DR: N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine (CAS 880808-98-0) is a chemical compound with molecular formula C12H17N5S and molecular weight 263.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-methylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
Also Known As: ASN 12417884, AN-465/42886279, N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine, (2-Methyl-benzyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine, N-[(2-methylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine
| Molecular Formula | C12H17N5S |
|---|---|
| Molecular Weight | 263.12 g/mol |
| LogP | 1.40042 |
| Topological Polar Surface Area | 55.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 263.12045 |
| Heavy Atoms | 18 |
| Complexity | 496.71793 |
Chemical Identifiers
| CAS Number | 880808-98-0 |
|---|---|
| SMILES | CC1=CC=CC=C1CNCCSC2=NN=NN2C |
Product Overview
N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine (CAS 880808-98-0), with molecular formula C12H17N5S and molecular weight 263.12 g/mol. IUPAC: N-[(2-methylphenyl)methyl]-2-(1-methyltetrazol-5-yl)sulfanylethanamine.
Chemical Property Profile of N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
Property Insights of N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
The XLogP value of 1.40042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine. With a topological polar surface area (TPSA) of 55.63 Ų, N-(2-methylbenzyl)-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-(2-methylbenzyl)-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-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
The CAS number of N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine is 880808-98-0.
What is the molecular formula of N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
The molecular formula of N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine is C12H17N5S.
What is the molecular weight of N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
The molecular weight of N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine is 263.12 g/mol.
Where can I buy N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
You can request a quote for N-(2-methylbenzyl)-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-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methylbenzyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.