RefChem:1086025
TL;DR: RefChem:1086025 (CAS 85975-26-4) is a chemical compound with molecular formula C20H24ClNO3 and molecular weight 361.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethoxy-2-oxoethyl)-methyl-[3-oxo-3-(4-phenylphenyl)propyl]azanium chloride
Also Known As: Glycine, N-(3-(1,1'-biphenyl)-4-yl-3-oxopropyl)-N-methyl-, ethyl ester, hydrochloride, (2-ethoxy-2-oxoethyl)-methyl-[3-oxo-3-(4-phenylphenyl)propyl]azanium;chloride, N-(3-(1,1'-Biphenyl)-4-yl-3-oxopropyl)-N-methylglycine ethyl ester hydrochloride, (2-ethoxy-2-oxoethyl)-methyl-[3-oxo-3-(4-phenylphenyl)propyl]azanium chloride, (2-Ethoxy-2-oxoethyl)-methyl-[3-oxo-3-(4-phenylphenyl)propyl]azaniumchloride
| Molecular Formula | C20H24ClNO3 |
|---|---|
| Molecular Weight | 361.14 g/mol |
| LogP | -0.99 |
| Topological Polar Surface Area | 47.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 361.14447 |
| Heavy Atoms | 25 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 85975-26-4 |
|---|---|
| SMILES | CCOC(=O)C[NH+](C)CCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2.[Cl-] |
| InChIKey | SZMIUTHKUFGAGE-UHFFFAOYSA-N |
Product Overview
RefChem:1086025 (CAS 85975-26-4), with molecular formula C20H24ClNO3 and molecular weight 361.14 g/mol. IUPAC: (2-ethoxy-2-oxoethyl)-methyl-[3-oxo-3-(4-phenylphenyl)propyl]azanium chloride.
Chemical Property Profile of RefChem:1086025
Property Insights of RefChem:1086025
The XLogP value of -0.99 indicates that RefChem:1086025 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:1086025 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1086025 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:1086025?
The CAS number of RefChem:1086025 is 85975-26-4.
What is the molecular formula of RefChem:1086025?
The molecular formula of RefChem:1086025 is C20H24ClNO3.
What is the molecular weight of RefChem:1086025?
The molecular weight of RefChem:1086025 is 361.14 g/mol.
Where can I buy RefChem:1086025?
You can request a quote for RefChem:1086025 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1086025?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1086025 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.