RefChem:1075683
TL;DR: RefChem:1075683 (CAS 2912-80-3) is a chemical compound with molecular formula C23H32ClNO3 and molecular weight 405.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl-[2-(2-ethoxy-2,2-diphenylacetyl)oxyethyl]-methylazanium chloride
Also Known As: Acetic acid, 2,2-diphenyl-2-ethoxy-, (2-(N-butyl-N-methylamino)ethyl) ester, hydrochloride, 2,2-Diphenyl-2-ethoxyacetic acid (2-(N-butyl-N-methylamino)ethyl) ester hydrochloride, Acetic acid, ethoxydiphenyl-, 2-(butylmethylamino)ethyl ester, hydrochloride, butyl-[2-(2-ethoxy-2,2-diphenylacetyl)oxyethyl]-methylazanium chloride, RefChem:1075683
| Molecular Formula | C23H32ClNO3 |
|---|---|
| Molecular Weight | 405.21 g/mol |
| LogP | -0.17 |
| Topological Polar Surface Area | 40.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 405.20706 |
| Heavy Atoms | 28 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 2912-80-3 |
|---|---|
| SMILES | CCCC[NH+](C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)OCC.[Cl-] |
| InChIKey | CBBBHOILUGRKBJ-UHFFFAOYSA-N |
Product Overview
RefChem:1075683 (CAS 2912-80-3), with molecular formula C23H32ClNO3 and molecular weight 405.21 g/mol. IUPAC: butyl-[2-(2-ethoxy-2,2-diphenylacetyl)oxyethyl]-methylazanium chloride.
Chemical Property Profile of RefChem:1075683
Property Insights of RefChem:1075683
The XLogP value of -0.17 indicates that RefChem:1075683 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.0 Ų, RefChem:1075683 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1075683 has 1 hydrogen bond donor(s) and 4 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:1075683?
The CAS number of RefChem:1075683 is 2912-80-3.
What is the molecular formula of RefChem:1075683?
The molecular formula of RefChem:1075683 is C23H32ClNO3.
What is the molecular weight of RefChem:1075683?
The molecular weight of RefChem:1075683 is 405.21 g/mol.
Where can I buy RefChem:1075683?
You can request a quote for RefChem:1075683 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075683?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075683 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.