Basic information
- Standard SMILES
CNN(C)C(=O)c1cc(Br)cc(Br)c1NC(=O)c1cc(Br)nn1-c1ncccc1Cl- InChIKey
PKMIKYHAZHSJLN-UHFFFAOYSA-N- Molecular formula
- C18H14Br3ClN6O2
- Average molar mass
- 621.5 g/mol
Names & identifiers
- Preferred name
- 3-bromo-N-[4,6-dibromo-2-(N,N'-dimethylhydrazinocarbonyl)phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide
- IUPAC
- 3-bromo-1-(3-chloro-2-pyridinyl)-N-[2,4-dibromo-6-[methyl(methylamino)carbamoyl]phenyl]pyrazole-5-carboxamide
Names & synonyms
SCHEMBL949995PKMIKYHAZHSJLN-UHFFFAOYSA-N3-bromo-N-[4,6-dibromo-2-(N,N'-dimethylhydrazinocarbonyl)phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide
Database identifiers
- PubChem CID
- 57780381
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 92.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 635
Related reactions
2 records
Linked notes
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