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

9H-fluoren-9-ylmethyl [2-({4-bromo-2-[(2-fluorophenyl)carbonyl]phenyl}amino)-2-oxoethyl]carbamate

HCID 57732434
NotesReactions

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)Nc1ccc(Br)cc1C(=O)c1ccccc1F
InChIKey
GLHSORLDPMXMOZ-UHFFFAOYSA-N
Molecular formula
C30H22BrFN2O4
Average molar mass
573.4 g/mol

Names & identifiers

Preferred name
9H-fluoren-9-ylmethyl [2-({4-bromo-2-[(2-fluorophenyl)carbonyl]phenyl}amino)-2-oxoethyl]carbamate
IUPAC
9H-fluoren-9-ylmethyl N-[2-[4-bromo-2-(2-fluorobenzoyl)anilino]-2-oxoethyl]carbamate

Names & synonyms

SCHEMBL12707597GLHSORLDPMXMOZ-UHFFFAOYSA-N9H-fluoren-9-ylmethyl [2-({4-bromo-2-[(2-fluorophenyl)carbonyl]phenyl}amino)-2-oxoethyl]carbamate

Database identifiers

PubChem CID
57732434

Properties

Computed structural propertiesFilling in

XLogP
6.6
Topological polar surface area
84.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
38
Formal charge
0
Complexity
836

Related reactions

4 records
New reaction record
HRID 281188 reaction equation
HRID 281188As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1150412 reaction equation
HRID 1150412As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1365054 reaction equation
HRID 1365054As productuspto-grants-2011_02
HRID 1365055 reaction equation
HRID 1365055As reactantuspto-grants-2011_02

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes