![[2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate structure](/static/products/539/5397-58-0.png)
[2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate
TL;DR: [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate (CAS 5397-58-0) is a chemical compound with molecular formula C15H21NO3 and molecular weight 263.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(butylamino)-2-oxoethyl] 2,4-dimethylbenzoate
Also Known As: [2-(butylamino)-2-oxoethyl] 2,4-dimethylbenzoate
| Molecular Formula | C15H21NO3 |
|---|---|
| Molecular Weight | 263.15 g/mol |
| LogP | 2.37654 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 263.15213 |
| Heavy Atoms | 19 |
| Complexity | 454.70395 |
Chemical Identifiers
| CAS Number | 5397-58-0 |
|---|---|
| SMILES | CCCCNC(=O)COC(=O)C1=C(C=C(C=C1)C)C |
Product Overview
[2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate (CAS 5397-58-0), with molecular formula C15H21NO3 and molecular weight 263.15 g/mol. IUPAC: [2-(butylamino)-2-oxoethyl] 2,4-dimethylbenzoate.
Chemical Property Profile of [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate
Property Insights of [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate
The XLogP value of 2.37654 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate. With a topological polar surface area (TPSA) of 55.4 Ų, [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate has 1 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 [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate?
The CAS number of [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate is 5397-58-0.
What is the molecular formula of [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate?
The molecular formula of [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate is C15H21NO3.
What is the molecular weight of [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate?
The molecular weight of [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate is 263.15 g/mol.
Where can I buy [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate?
You can request a quote for [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(Butylamino)-2-oxoethyl] 2,4-dimethylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.