HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

Methyl 2-ethoxy-3-[4-[[2-(4-fluoro-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-2-methylphenyl]propanoate

HCID 69280523
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(Cc1ccc(OCc2nc(-c3ccc(F)c(C)c3)oc2C)cc1C)C(=O)OC
InChIKey
UUARENYMZLGMIU-UHFFFAOYSA-N
Molecular formula
C25H28FNO5
Average molar mass
441.5 g/mol

Names & identifiers

Preferred name
Methyl 2-ethoxy-3-[4-[[2-(4-fluoro-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-2-methylphenyl]propanoate
IUPAC
methyl 2-ethoxy-3-[4-[[2-(4-fluoro-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-2-methylphenyl]propanoate

Names & synonyms

SCHEMBL5017525

Database identifiers

PubChem CID
69280523

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
70.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
10
Heavy atoms
32
Formal charge
0
Complexity
593

Related reactions

2 records
New reaction record
HRID 150947 reaction equation
HRID 150947As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 200909 reaction equation
HRID 200909As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes