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1-[2-(4-Chloro-phenyl)-2H-indazol-3-yl]-3-cyclohexyl-1-phenyl-urea

HCID 45110885
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(NC1CCCCC1)N(c1ccccc1)c1c2ccccc2nn1-c1ccc(Cl)cc1
InChIKey
LNYUOULPUIAUMG-UHFFFAOYSA-N
Molecular formula
C26H25ClN4O
Average molar mass
445 g/mol

Names & identifiers

Preferred name
1-[2-(4-Chloro-phenyl)-2H-indazol-3-yl]-3-cyclohexyl-1-phenyl-urea
IUPAC
1-[2-(4-chlorophenyl)indazol-3-yl]-3-cyclohexyl-1-phenylurea

Names & synonyms

SCHEMBL1094213LNYUOULPUIAUMG-UHFFFAOYSA-N1-[2-(4-Chloro-phenyl)-2H-indazol-3-yl]-3-cyclohexyl-1-phenyl-urea

Database identifiers

PubChem CID
45110885

Properties

Computed structural properties

XLogP
6.7
Topological polar surface area
50.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
32
Formal charge
0
Complexity
613

Related reactions

2 records
New reaction record
HRID 951290 reaction equation
HRID 951290As productValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1690535 reaction equation
HRID 1690535As productuspto-grants-2012_04

Compound notes

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