Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride
TL;DR: Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride (CAS 940-63-6) is a chemical compound with molecular formula C9H13ClN2S and molecular weight 216.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[amino-[(4-methylphenyl)methylsulfanyl]methylidene]azanium chloride
Also Known As: amino[(4-methylbenzyl)sulfanyl]methaniminium chloride, 10P-079, [amino-[(4-methylphenyl)methylsulfanyl]methylidene]azanium Chloride, {[(4-methylphenyl)methyl]sulfanyl}methanimidamide hydrochloride, [amino({[(4-methylphenyl)methyl]sulfanyl})methylidene]azanium chloride
| Molecular Formula | C9H13ClN2S |
|---|---|
| Molecular Weight | 216.05 g/mol |
| LogP | -2.69398 |
| Topological Polar Surface Area | 51.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.0488 |
| Heavy Atoms | 13 |
| Complexity | 271.44812 |
Chemical Identifiers
| CAS Number | 940-63-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CSC(=[NH2+])N.[Cl-] |
Product Overview
Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride (CAS 940-63-6), with molecular formula C9H13ClN2S and molecular weight 216.05 g/mol. IUPAC: [amino-[(4-methylphenyl)methylsulfanyl]methylidene]azanium chloride.
Chemical Property Profile of Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride
Property Insights of Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride
The XLogP value of -2.69398 indicates that Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.61 Ų, Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride has 2 hydrogen bond donor(s) and 1 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 Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride?
The CAS number of Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride is 940-63-6.
What is the molecular formula of Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride?
The molecular formula of Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride is C9H13ClN2S.
What is the molecular weight of Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride?
The molecular weight of Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride is 216.05 g/mol.
Where can I buy Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride?
You can request a quote for Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride?
Yes, KEHONG BIO provides custom synthesis services for Amino[(4-methylbenzyl)sulfanyl]methaniminium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.