RefChem:1086027
TL;DR: RefChem:1086027 (CAS 85975-25-3) is a chemical compound with molecular formula C14H19Cl2NO3 and molecular weight 319.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-chlorophenyl)-3-oxopropyl]-(2-ethoxy-2-oxoethyl)-methylazanium chloride
Also Known As: Glycine, N-(3-(4-chlorophenyl)-3-oxopropyl)-N-methyl-, ethyl ester, hydrochloride, N-(3-(4-Chlorophenyl)-3-oxopropyl)-N-methylglycine ethyl ester hydrochloride, [3-(4-Chlorophenyl)-3-oxopropyl]-(2-ethoxy-2-oxoethyl)-methylazaniumchloride, [3-(4-chlorophenyl)-3-oxopropyl]-(2-ethoxy-2-oxoethyl)-methylazanium chloride, RefChem:1086027
| Molecular Formula | C14H19Cl2NO3 |
|---|---|
| Molecular Weight | 319.07 g/mol |
| LogP | -2.01 |
| Topological Polar Surface Area | 47.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 319.0742 |
| Heavy Atoms | 20 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 85975-25-3 |
|---|---|
| SMILES | CCOC(=O)C[NH+](C)CCC(=O)C1=CC=C(C=C1)Cl.[Cl-] |
| InChIKey | ODRBUERNZPKKFE-UHFFFAOYSA-N |
Product Overview
RefChem:1086027 (CAS 85975-25-3), with molecular formula C14H19Cl2NO3 and molecular weight 319.07 g/mol. IUPAC: [3-(4-chlorophenyl)-3-oxopropyl]-(2-ethoxy-2-oxoethyl)-methylazanium chloride.
Chemical Property Profile of RefChem:1086027
Property Insights of RefChem:1086027
The XLogP value of -2.01 indicates that RefChem:1086027 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 47.8 Ų, RefChem:1086027 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1086027 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:1086027?
The CAS number of RefChem:1086027 is 85975-25-3.
What is the molecular formula of RefChem:1086027?
The molecular formula of RefChem:1086027 is C14H19Cl2NO3.
What is the molecular weight of RefChem:1086027?
The molecular weight of RefChem:1086027 is 319.07 g/mol.
Where can I buy RefChem:1086027?
You can request a quote for RefChem:1086027 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1086027?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1086027 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.