Basic information
- Standard SMILES
COc1ccc(NC(=O)Nc2ccc(F)c(F)c2)cc1-c1c(Cl)cnn1C(C)C- InChIKey
NIFANLFQYSMZOG-UHFFFAOYSA-N- Molecular formula
- C20H19ClF2N4O2
- Average molar mass
- 420.8 g/mol
Names & identifiers
- Preferred name
- 1-[3-(4-Chloro-2-isopropyl-2H-pyrazol-3-yl)-4-methoxy-phenyl]-3-(3,4-difluoro-phenyl)-urea
- IUPAC
- 1-[3-(4-chloro-1-propan-2-ylpyrazol-5-yl)-4-methoxyphenyl]-3-(3,4-difluorophenyl)urea
Names & synonyms
SCHEMBL5052915SCHEMBL29573821NIFANLFQYSMZOG-UHFFFAOYSA-N1-[3-(4-Chloro-2-isopropyl-2H-pyrazol-3-yl)-4-methoxy-phenyl]-3-(3,4-difluoro-phenyl)-urea
Database identifiers
- PubChem CID
- 11625940
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 68.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 559
Related reactions
3 records
Compound notes
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