HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.9
  1. Home
  2. /Compound

4-Benzyl-3-[2-[[4-(propoxymethyl)naphthalen-2-yl]methyl]butanoyl]-1,3-oxazolidin-2-one

HCID 21458765
New noteNew reactionRequest quotesPrint preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCOCc1cc(CC(CC)C(=O)N2C(=O)OCC2Cc2ccccc2)cc2ccccc12
InChIKey
IBJUMYOPORRCAF-UHFFFAOYSA-N
Molecular formula
C29H33NO4
Average molar mass
459.6 g/mol

Names & identifiers

Preferred name
4-Benzyl-3-[2-[[4-(propoxymethyl)naphthalen-2-yl]methyl]butanoyl]-1,3-oxazolidin-2-one
IUPAC
4-benzyl-3-[2-[[4-(propoxymethyl)naphthalen-2-yl]methyl]butanoyl]-1,3-oxazolidin-2-one

Names & synonyms

SCHEMBL6044030

Database identifiers

PubChem CID
21458765

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
10
Heavy atoms
34
Formal charge
0
Complexity
661

Suppliers

Loading…

Open inquiries

Loading…

Related reactions

1 records
New reaction record
HRID 1142357 reaction equation
HRID 1142357As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes