[2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate

C23H20O4 — CID 7758309

IUPAC[2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate
SMILESCCOc1ccccc1C(=O)OCC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H20O4/c1-2-26-22-11-7-6-10-20(22)23(25)27-16-21(24)19-14-12-18(13-15-19)17-8-4-3-5-9-17/h3-15H,2,16H2,1H3
InChIKeyGQSJOUHQNKYHMW-UHFFFAOYSA-N
MW360.41 g/mol
LogP4.79
Rot. Bonds7

About [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate

[2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate (PubChem CID 7758309) has the molecular formula C23H20O4 and a molecular weight of 360.41 g/mol. Its IUPAC name is [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate.

Molecular Properties

Compound Name[2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate
PubChem CID7758309
Molecular FormulaC23H20O4
Molecular Weight360.41 g/mol
Exact Mass360.14
IUPAC Name[2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate
SMILESCCOc1ccccc1C(=O)OCC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H20O4/c1-2-26-22-11-7-6-10-20(22)23(25)27-16-21(24)19-14-12-18(13-15-19)17-8-4-3-5-9-17/h3-15H,2,16H2,1H3
InChIKeyGQSJOUHQNKYHMW-UHFFFAOYSA-N
XLogP4.79
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(4-acetamidophenyl)-2-oxoethyl] 2-ethoxybenzoate
CID 18075363
[2-(4-ethoxyphenyl)-2-oxoethyl] 2-phenoxybenzoate
CID 7760680
[2-oxo-2-(2-phenyl-1H-indol-3-yl)ethyl] 2-ethoxybenzoate
CID 7758132
[2-[4-(3-acetamidopropyl)phenyl]-2-oxoethyl] 2-ethoxybenzoate
CID 7874648
phenacyl 2-phenylmethoxybenzoate
CID 2565163
ethyl 2-ethoxy-4-phenylbenzoate
CID 22494159
[2-(4-methoxyphenyl)-2-oxoethyl] 2-phenylmethoxybenzoate
CID 2358793
[2-oxo-2-(4-phenylphenyl)ethyl] 3-ethoxy-5-iodo-4-propoxybenzoate
CID 126371723
[2-oxo-2-(4-phenylphenyl)ethyl] 4-ethoxy-3-iodo-5-methoxybenzoate
CID 126371683
2-ethoxybenzenecarboperoxoic acid
CID 22314606
[2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-phenylbenzoate
CID 7229145
[2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-(2-amino-2-oxoethoxy)benzoate
CID 38909124

Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate?
The IUPAC name of [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate (CID 7758309) is [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate.
What is the SMILES notation for [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate?
The canonical SMILES for [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate is CCOc1ccccc1C(=O)OCC(=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate?
The InChIKey is GQSJOUHQNKYHMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20O4/c1-2-26-22-11-7-6-10-20(22)23(25)27-16-21(24)19-14-12-18(13-15-19)17-8-4-3-5-9-17/h3-15H,2,16H2,1H3.
What are the key properties of [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate?
[2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate has a molecular weight of 360.41 g/mol, XLogP of 4.79, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(4-phenylphenyl)ethyl] 2-ethoxybenzoate is sourced from PubChem (CID 7758309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).