![[(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate structure](/static/products/876/876534-75-7.png)
[(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate
TL;DR: [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate (CAS 876534-75-7) is a chemical compound with molecular formula C19H21NO3 and molecular weight 311.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(2-phenylethylamino)ethyl] 3,4-dimethylbenzoate
Also Known As: starbld0003256, [(2-phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate, 2-oxo-2-(phenethylamino)ethyl 3,4-dimethylbenzoate, AB00746449-01, [2-oxo-2-(2-phenylethylamino)ethyl] 3,4-dimethylbenzoate
| Molecular Formula | C19H21NO3 |
|---|---|
| Molecular Weight | 311.15 g/mol |
| LogP | 2.81914 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.15213 |
| Heavy Atoms | 23 |
| Complexity | 680.269 |
Chemical Identifiers
| CAS Number | 876534-75-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)OCC(=O)NCCC2=CC=CC=C2)C |
Product Overview
[(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate (CAS 876534-75-7), with molecular formula C19H21NO3 and molecular weight 311.15 g/mol. IUPAC: [2-oxo-2-(2-phenylethylamino)ethyl] 3,4-dimethylbenzoate.
Chemical Property Profile of [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate
Property Insights of [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate
The XLogP value of 2.81914 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate. With a topological polar surface area (TPSA) of 55.4 Ų, [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(2-Phenylethyl)carbamoyl]methyl 3,4-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-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate?
The CAS number of [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate is 876534-75-7.
What is the molecular formula of [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate?
The molecular formula of [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate is C19H21NO3.
What is the molecular weight of [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate?
The molecular weight of [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate is 311.15 g/mol.
Where can I buy [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate?
You can request a quote for [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(2-Phenylethyl)carbamoyl]methyl 3,4-dimethylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.