![(Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid structure](/static/products/2545/2545-54-2.webp)
(Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid
TL;DR: (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid (CAS 2545-54-2) is a chemical compound with molecular formula C20H19NO6 and molecular weight 369.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-2-[3-oxo-3-(4-phenylphenyl)propyl]propanedioic acid
Also Known As: KST-1A3641, (acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid, 2-acetamido-2-[3-oxo-3-(4-phenylphenyl)propyl]propanedioic a, 2-acetamido-2-[3-oxo-3-(4-phenylphenyl)propyl]propanedioic acid, Acetamido[3-([1,1'-biphenyl]-4-yl)-3-oxopropyl]propanedioic acid
| Molecular Formula | C20H19NO6 |
|---|---|
| Molecular Weight | 369.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 369.12125 |
| Heavy Atoms | 27 |
| Complexity | 559.0 |
Chemical Identifiers
| CAS Number | 2545-54-2 |
|---|---|
| SMILES | CC(=O)NC(CCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2)(C(=O)O)C(=O)O |
| InChIKey | NIXYUSQHCZIOHS-UHFFFAOYSA-N |
Product Overview
(Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid (CAS 2545-54-2), with molecular formula C20H19NO6 and molecular weight 369.12 g/mol. IUPAC: 2-acetamido-2-[3-oxo-3-(4-phenylphenyl)propyl]propanedioic acid.
Chemical Property Profile of (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid
Property Insights of (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid. Following Lipinski's Rule of Five, (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid has 3 hydrogen bond donor(s) and 6 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 (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid?
The CAS number of (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid is 2545-54-2.
What is the molecular formula of (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid?
The molecular formula of (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid is C20H19NO6.
What is the molecular weight of (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid?
The molecular weight of (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid is 369.12 g/mol.
Where can I buy (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid?
You can request a quote for (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for (Acetylamino)[3-(biphenyl-4-yl)-3-oxopropyl]propanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.