Semiamitraz hydrochloride
TL;DR: Semiamitraz hydrochloride (CAS 51550-52-8) is a chemical compound with molecular formula C10H15ClN2 and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethylphenyl)-N'-methylmethanimidamide;hydrochloride
Also Known As: Semiamitraz hydrochloride, Semiamitraz chloride, Amitraz Impurity 3 HCl, AMITRAZ METABOLITE HYDROCHLORIDE, BTS 27271-HCl
| Molecular Formula | C10H15ClN2 |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 2.79524 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.09238 |
| Heavy Atoms | 13 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 51550-52-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC=NC)C.Cl |
| InChIKey | VXSNJXDZTGFDMB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Semiamitraz hydrochloride (CAS 51550-52-8), with molecular formula C10H15ClN2 and molecular weight 198.09 g/mol. IUPAC: N-(2,4-dimethylphenyl)-N'-methylmethanimidamide;hydrochloride.
Chemical Property Profile of Semiamitraz hydrochloride
Property Insights of Semiamitraz hydrochloride
The XLogP value of 2.79524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Semiamitraz hydrochloride. With a topological polar surface area (TPSA) of 24.4 Ų, Semiamitraz hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Semiamitraz hydrochloride 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 Semiamitraz hydrochloride?
The CAS number of Semiamitraz hydrochloride is 51550-52-8.
What is the molecular formula of Semiamitraz hydrochloride?
The molecular formula of Semiamitraz hydrochloride is C10H15ClN2.
What is the molecular weight of Semiamitraz hydrochloride?
The molecular weight of Semiamitraz hydrochloride is 198.09 g/mol.
Where can I buy Semiamitraz hydrochloride?
You can request a quote for Semiamitraz hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Semiamitraz hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Semiamitraz hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.