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[2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate structure
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[2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate

TL;DR: [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate (CAS 1002280-01-4) is a chemical compound with molecular formula C17H16ClNO3 and molecular weight 317.08188 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl] benzoate

Also Known As: 2-((4-chlorophenethyl)amino)-2-oxoethyl benzoate, [2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl] benzoate, {[2-(4-CHLOROPHENYL)ETHYL]CARBAMOYL}METHYL BENZOATE, 2-{[2-(4-chlorophenyl)ethyl]amino}-2-oxoethyl benzoate, F6609-3560

CAS Number
1002280-01-4
Molecular Formula
C17H16ClNO3
Molecular Weight
317.08188 g/mol
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Technical Specifications

Molecular FormulaC17H16ClNO3
Molecular Weight317.08188 g/mol
XLogP3.5
Topological Polar Surface Area (TPSA)55.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds7
Exact Mass317.08188 Da
Heavy Atoms22
Complexity361.0
SMILESC1=CC=C(C=C1)C(=O)OCC(=O)NCCC2=CC=C(C=C2)Cl
InChIKeyREYBVHPGVQQKNK-UHFFFAOYSA-N

Chemical Property Profile of [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate

XLogP
3.5
TPSA (Topological Polar Surface Area)
55.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
7
Heavy Atoms
22
Complexity
361.0
Exact Mass
317.08188
Monoisotopic Mass
317.08188
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate

The XLogP value of 3.5 indicates that [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate 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

What is the CAS number of [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate?

The CAS number of [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate is 1002280-01-4.

What is the molecular formula of [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate?

The molecular formula of [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate is C17H16ClNO3.

What is the molecular weight of [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate?

The molecular weight of [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate is 317.08188 g/mol.

Where can I buy [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate?

You can request a quote for [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate?

Yes, CoreyChem provides custom synthesis services for [2-[2-(4-Chlorophenyl)ethylamino]-2-oxoethyl] benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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