1-[3-(4-Chloro-2-methyl-2H-pyrazol-3-yl)-4-methoxy-phenyl]-3-(2,4-difluoro-phenyl)urea

HCID 11675550

Basic information

Standard SMILES
COc1ccc(NC(=O)Nc2ccc(F)cc2F)cc1-c1c(Cl)cnn1C
InChIKey
UKZQBKVXASGHBG-UHFFFAOYSA-N
Molecular formula
C18H15ClF2N4O2
Average molar mass
392.8 g/mol
Monoisotopic mass
392.0851598

Names & identifiers

Preferred name
1-[3-(4-Chloro-2-methyl-2H-pyrazol-3-yl)-4-methoxy-phenyl]-3-(2,4-difluoro-phenyl)urea
IUPAC
1-[3-(4-chloro-1-methylpyrazol-5-yl)-4-methoxyphenyl]-3-(2,4-difluorophenyl)urea

Names & synonyms

CHEMBL598173SCHEMBL1167074SCHEMBL29573262UKZQBKVXASGHBG-UHFFFAOYSA-N1-[3-(4-Chloro-2-methyl-2H-pyrazol-3-yl)-4-methoxy-phenyl]-3-(2,4-difluoro-phenyl)-urea1-[3-(4-Chloro-2-methyl-2H-pyrazol-3-yl)-4-methoxy-phenyl]-3-(2,4-difluoro-phenyl)urea

Database identifiers

PubChem CID
11675550
ChEMBL
CHEMBL598173

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
68.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
27

Related reactions

9 records

Compound notes

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