Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride
TL;DR: Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride (CAS 63979-58-8) is a chemical compound with molecular formula C18H25ClN2S and molecular weight 336.1427 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[3-(N-(2-methylsulfanylphenyl)anilino)propyl]azanium chloride
Also Known As: N-(gamma-Dimethylaminopropyl)-2-methyl thiodiphenylamine hydrochloride, DIPHENYLAMINE, N-(3-DIMETHYLAMINOPROPYL)-2-METHYLTHIO-, HYDROCHLORIDE, dimethyl-[3-(N-(2-methylsulfanylphenyl)anilino)propyl]azanium chloride, 1,3-Propanediamine, N,N-dimethyl-N'-[2-(methylthio)phenyl]-N'-phenyl-, monohydrochloride
Technical Specifications
| Molecular Formula | C18H25ClN2S |
| Molecular Weight | 336.1427 g/mol |
| XLogP | 0.09 |
| Topological Polar Surface Area (TPSA) | 33.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 336.1427 Da |
| Heavy Atoms | 22 |
| Complexity | 276.0 |
| SMILES | C[NH+](C)CCCN(C1=CC=CC=C1)C2=CC=CC=C2SC.[Cl-] |
| InChIKey | KZLLWAFHYQHQJN-UHFFFAOYSA-N |
Chemical Property Profile of Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride
Property Insights of Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride
The XLogP value of 0.09 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride. With a topological polar surface area (TPSA) of 33.0 Ų, Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride has 1 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 Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride?
The CAS number of Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride is 63979-58-8.
What is the molecular formula of Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride?
The molecular formula of Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride is C18H25ClN2S.
What is the molecular weight of Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride?
The molecular weight of Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride is 336.1427 g/mol.
Where can I buy Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride?
You can request a quote for Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Diphenylamine, N-(3-dimethylaminopropyl)-2-methylthio-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.