![4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate structure](/static/products/4123/412335-18-3.webp)
4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate
TL;DR: 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate (CAS 412335-18-3) is a chemical compound with molecular formula C14H17NO4 and molecular weight 263.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-acetamido-3-oxobutyl)phenyl] acetate
Also Known As: 4-[2-(acetylamino)-3-oxobutyl]phenyl acetate, ZERO/005319, 4-(2-ACETAMIDO-3-OXOBUTYL)PHENYL ACETATE, [4-(2-acetamido-3-oxobutyl)phenyl] acetate, N-(p-Acetoxy-alpha-acetylphenethyl)acetamide
| Molecular Formula | C14H17NO4 |
|---|---|
| Molecular Weight | 263.12 g/mol |
| LogP | 1.2481 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.11575 |
| Heavy Atoms | 19 |
| Complexity | 478.72427 |
Chemical Identifiers
| CAS Number | 412335-18-3 |
|---|---|
| SMILES | CC(=O)C(CC1=CC=C(C=C1)OC(=O)C)NC(=O)C |
Product Overview
4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate (CAS 412335-18-3), with molecular formula C14H17NO4 and molecular weight 263.12 g/mol. IUPAC: [4-(2-acetamido-3-oxobutyl)phenyl] acetate.
Chemical Property Profile of 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate
Property Insights of 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate
The XLogP value of 1.2481 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate. Following Lipinski's Rule of Five, 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate 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 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate?
The CAS number of 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate is 412335-18-3.
What is the molecular formula of 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate?
The molecular formula of 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate is C14H17NO4.
What is the molecular weight of 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate?
The molecular weight of 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate is 263.12 g/mol.
Where can I buy 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate?
You can request a quote for 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(Acetylamino)-3-oxobutyl]phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.