Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride
TL;DR: Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride (CAS 95623-02-2) is a chemical compound with molecular formula C24H26ClNO2 and molecular weight 395.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,2-diphenylacetyl)oxy-1-phenylethyl]-dimethylazanium chloride
Also Known As: FC 645, Diphenylacetic acid beta-(dimethylamino)phenethyl ester hydrochloride, [2-(2,2-diphenylacetyl)oxy-1-phenylethyl]-dimethylazanium chloride, ACETIC ACID, DIPHENYL-, beta-(DIMETHYLAMINO)PHENETHYL ESTER, HYDROCHLORIDE
| Molecular Formula | C24H26ClNO2 |
|---|---|
| Molecular Weight | 395.17 g/mol |
| LogP | 0.25 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 395.1652 |
| Heavy Atoms | 28 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 95623-02-2 |
|---|---|
| SMILES | C[NH+](C)C(COC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3.[Cl-] |
| InChIKey | WUIKPDLIYRJOAA-UHFFFAOYSA-N |
Product Overview
Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride (CAS 95623-02-2), with molecular formula C24H26ClNO2 and molecular weight 395.17 g/mol. IUPAC: [2-(2,2-diphenylacetyl)oxy-1-phenylethyl]-dimethylazanium chloride.
Chemical Property Profile of Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride
Property Insights of Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride
The XLogP value of 0.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride. With a topological polar surface area (TPSA) of 30.7 Ų, Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, 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
Frequently Asked Questions
What is the CAS number of Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride?
The CAS number of Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride is 95623-02-2.
What is the molecular formula of Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride?
The molecular formula of Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride is C24H26ClNO2.
What is the molecular weight of Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride?
The molecular weight of Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride is 395.17 g/mol.
Where can I buy Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride?
You can request a quote for Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, diphenyl-, beta-(dimethylamino)phenethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.