1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate
TL;DR: 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate (CAS 496874-85-2) is a chemical compound with molecular formula C19H19NO3 and molecular weight 309.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-benzyl-2-(4-methylphenyl)-4-oxoazetidin-3-yl] acetate
Also Known As: 1-benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate, AN-967/15488251, [1-benzyl-2-(4-methylphenyl)-4-oxoazetidin-3-yl] acetate
| Molecular Formula | C19H19NO3 |
|---|---|
| Molecular Weight | 309.14 g/mol |
| LogP | 3.01022 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.1365 |
| Heavy Atoms | 23 |
| Complexity | 709.1544 |
Chemical Identifiers
| CAS Number | 496874-85-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C(C(=O)N2CC3=CC=CC=C3)OC(=O)C |
Product Overview
1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate (CAS 496874-85-2), with molecular formula C19H19NO3 and molecular weight 309.14 g/mol. IUPAC: [1-benzyl-2-(4-methylphenyl)-4-oxoazetidin-3-yl] acetate.
Chemical Property Profile of 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate
Property Insights of 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate
The XLogP value of 3.01022 indicates that 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate has 0 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 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate?
The CAS number of 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate is 496874-85-2.
What is the molecular formula of 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate?
The molecular formula of 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate is C19H19NO3.
What is the molecular weight of 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate?
The molecular weight of 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate is 309.14 g/mol.
Where can I buy 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate?
You can request a quote for 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-2-(4-methylphenyl)-4-oxo-3-azetidinyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.