Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride
TL;DR: Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride (CAS 40284-11-5) is a chemical compound with molecular formula C15H27ClN2S and molecular weight 302.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(3,5-dimethyl-1-adamantyl)methyl]-2-sulfanylethanimidamide;hydrochloride
Also Known As: (2R,6S)-2,6-dimethylpiperazine, N-((3,5-Dimethyl)-1-adamantyl)methyl-2-mercaptoacetamidine hydrochloride, Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride, Ethanimidamide, N-((3,5-dimethyltricyclo(3.3.1.13,7)dec-1-yl)methyl)-2-mercapto-, monohydrochloride, N'-[(3,5-dimethyl-1-adamantyl)methyl]-2-sulfanylethanimidami
| Molecular Formula | C15H27ClN2S |
|---|---|
| Molecular Weight | 302.16 g/mol |
| LogP | 3.69 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.15836 |
| Heavy Atoms | 19 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 40284-11-5 |
|---|---|
| SMILES | CC12CC3CC(C1)(CC(C3)(C2)CN=C(CS)N)C.Cl |
| InChIKey | ZCIIPKQTVYFBHV-UHFFFAOYSA-N |
Product Overview
Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride (CAS 40284-11-5), with molecular formula C15H27ClN2S and molecular weight 302.16 g/mol. IUPAC: N'-[(3,5-dimethyl-1-adamantyl)methyl]-2-sulfanylethanimidamide;hydrochloride.
Chemical Property Profile of Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride
Property Insights of Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride
The XLogP value of 3.69 indicates that Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride has 3 hydrogen bond donor(s) and 2 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 Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride?
The CAS number of Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride is 40284-11-5.
What is the molecular formula of Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride?
The molecular formula of Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride is C15H27ClN2S.
What is the molecular weight of Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride?
The molecular weight of Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride is 302.16 g/mol.
Where can I buy Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride?
You can request a quote for Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Acetamidine, N-((3,5-dimethyl)-1-adamantyl)methyl-2-mercapto-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.