RefChem:345129
TL;DR: RefChem:345129 (CAS 35877-19-1) is a chemical compound with molecular formula C21H30ClNO2 and molecular weight 363.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2,6-dimethylphenyl)methoxy]ethyl-hydroxy-dimethylazanium chloride
Also Known As: Ethylamine, 2-(bis(2,6-dimethylphenyl)methoxy)-N,N-dimethyl-, N-oxide, hydrochloride, 2-(Bis(2,6-dimethylphenyl)methoxy)-N,N-dimethylethylamine N-oxide hydrochloride, {2-[Bis(2,6-dimethylphenyl)methoxy]ethyl}(hydroxy)dimethylammonium chloride, 2-[bis(2,6-dimethylphenyl)methoxy]ethyl-hydroxy-dimethylazanium chloride, {2-[Bis(2,6-dimethylphenyl)methoxy]ethyl}(hydroxy)di(methyl)ammonium chloride
| Molecular Formula | C21H30ClNO2 |
|---|---|
| Molecular Weight | 363.20 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.1965 |
| Heavy Atoms | 25 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 35877-19-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)C(C2=C(C=CC=C2C)C)OCC[N+](C)(C)O.[Cl-] |
| InChIKey | ANFHFSLBPKENNM-UHFFFAOYSA-M |
Product Overview
RefChem:345129 (CAS 35877-19-1), with molecular formula C21H30ClNO2 and molecular weight 363.20 g/mol. IUPAC: 2-[bis(2,6-dimethylphenyl)methoxy]ethyl-hydroxy-dimethylazanium chloride.
Chemical Property Profile of RefChem:345129
Property Insights of RefChem:345129
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:345129. With a topological polar surface area (TPSA) of 29.5 Ų, RefChem:345129 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:345129 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
Frequently Asked Questions
What is the CAS number of RefChem:345129?
The CAS number of RefChem:345129 is 35877-19-1.
What is the molecular formula of RefChem:345129?
The molecular formula of RefChem:345129 is C21H30ClNO2.
What is the molecular weight of RefChem:345129?
The molecular weight of RefChem:345129 is 363.20 g/mol.
Where can I buy RefChem:345129?
You can request a quote for RefChem:345129 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:345129?
Yes, KEHONG BIO provides custom synthesis services for RefChem:345129 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.