o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride
TL;DR: o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride (CAS 100620-36-8) is a chemical compound with molecular formula C13H20Cl2N2OS and molecular weight 322.06735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(2-chloro-6-methylanilino)-2-oxoethyl]sulfanylethyl-dimethylazanium chloride
Also Known As: C 5458, 6'-Chloro-2-(2-(dimethylamino)ethylthio)-o-acetotoluidide hydrochloride, o-ACETOTOLUIDIDE, 6'-CHLORO-2-(2-(DIMETHYLAMINO)ETHYLTHIO)-, HYDROCHLORIDE, 2-[2-(2-chloro-6-methylanilino)-2-oxoethyl]sulfanylethyl-dimethylazanium chloride, 2-({2-[(2-chloro-6-methylphenyl)amino]-2-oxoethyl}sulfanyl)-n,n-dimethylethanaminium chloride
Technical Specifications
| Molecular Formula | C13H20Cl2N2OS |
| Molecular Weight | 322.06735 g/mol |
| XLogP | -1.53 |
| Topological Polar Surface Area (TPSA) | 58.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 322.06735 Da |
| Heavy Atoms | 19 |
| Complexity | 263.0 |
| SMILES | CC1=C(C(=CC=C1)Cl)NC(=O)CSCC[NH+](C)C.[Cl-] |
| InChIKey | SUKKDJCCWYAAKN-UHFFFAOYSA-N |
Chemical Property Profile of o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride
Property Insights of o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride
The XLogP value of -1.53 indicates that o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.8 Ų, o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride?
The CAS number of o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride is 100620-36-8.
What is the molecular formula of o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride?
The molecular formula of o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride is C13H20Cl2N2OS.
What is the molecular weight of o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride?
The molecular weight of o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride is 322.06735 g/mol.
Where can I buy o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride?
You can request a quote for o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for o-Acetotoluidide, 6'-chloro-2-(2-(dimethylamino)ethylthio)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.