![[(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate structure](/static/products/100/1004644-41-0.png)
[(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate
TL;DR: [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate (CAS 1004644-41-0) is a chemical compound with molecular formula C18H19NO3 and molecular weight 297.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(2-phenylethylamino)ethyl] 4-methylbenzoate
Also Known As: [(2-PHENYLETHYL)CARBAMOYL]METHYL 4-METHYLBENZOATE|2-oxo-2-(phenethylamino)ethyl 4-methylbenzoate|[2-oxo-2-(2-phenylethylamino)ethyl] 4-methylbenzoate|[2-oxo-2-(phenethylamino)ethyl] 4-methylbenzoate|2-oxo-2-[(2-phenylethyl)amino]ethyl 4-methylbenzoate|F6609-4215
| Molecular Formula | C18H19NO3 |
|---|---|
| Molecular Weight | 297.14 g/mol |
| LogP | 2.51072 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 297.1365 |
| Heavy Atoms | 22 |
| Complexity | 620.54034 |
Chemical Identifiers
| CAS Number | 1004644-41-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OCC(=O)NCCC2=CC=CC=C2 |
Product Overview
[(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate (CAS 1004644-41-0), with molecular formula C18H19NO3 and molecular weight 297.14 g/mol. IUPAC: [2-oxo-2-(2-phenylethylamino)ethyl] 4-methylbenzoate.
Chemical Property Profile of [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate
Property Insights of [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate
The XLogP value of 2.51072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate. With a topological polar surface area (TPSA) of 55.4 Ų, [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate 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 4-methylbenzoate?
The CAS number of [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate is 1004644-41-0.
What is the molecular formula of [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate?
The molecular formula of [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate is C18H19NO3.
What is the molecular weight of [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate?
The molecular weight of [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate is 297.14 g/mol.
Where can I buy [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate?
You can request a quote for [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate 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 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(2-Phenylethyl)carbamoyl]methyl 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.