[(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate
TL;DR: [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate (CAS 730256-24-3) is a chemical compound with molecular formula C17H15Cl2NO3 and molecular weight 351.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(1-phenylethylamino)ethyl] 3,4-dichlorobenzoate
Also Known As: starbld0002408, [(1-phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate, 2-oxo-2-((1-phenylethyl)amino)ethyl 3,4-dichlorobenzoate, AB00717465-01, [2-oxo-2-(1-phenylethylamino)ethyl] 3,4-dichlorobenzoate
| Molecular Formula | C17H15Cl2NO3 |
|---|---|
| Molecular Weight | 351.04 g/mol |
| LogP | 4.0276 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.0429 |
| Heavy Atoms | 23 |
| Complexity | 704.2396 |
Chemical Identifiers
| CAS Number | 730256-24-3 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NC(=O)COC(=O)C2=CC(=C(C=C2)Cl)Cl |
Product Overview
[(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate (CAS 730256-24-3), with molecular formula C17H15Cl2NO3 and molecular weight 351.04 g/mol. IUPAC: [2-oxo-2-(1-phenylethylamino)ethyl] 3,4-dichlorobenzoate.
Chemical Property Profile of [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate
Property Insights of [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate
The XLogP value of 4.0276 indicates that [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate 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 [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate?
The CAS number of [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate is 730256-24-3.
What is the molecular formula of [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate?
The molecular formula of [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate is C17H15Cl2NO3.
What is the molecular weight of [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate?
The molecular weight of [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate is 351.04 g/mol.
Where can I buy [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate?
You can request a quote for [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(1-Phenylethyl)carbamoyl]methyl 3,4-dichlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.