Basic information
- Standard SMILES
O=C(NCc1ccc(F)cc1)c1ccc(S(=O)(=O)n2nc(Cl)c3ccccc32)cc1- InChIKey
PICJCWHZRLHLNR-UHFFFAOYSA-N- Molecular formula
- C21H15ClFN3O3S
- Average molar mass
- 443.9 g/mol
- Monoisotopic mass
- 443.0506684
Names & identifiers
- Preferred name
- 4-(3-Chloro-indazole-1-sulfonyl)-N-(4-fluoro-benzyl)-benzamide
- IUPAC
- 4-(3-chloroindazol-1-yl)sulfonyl-N-[(4-fluorophenyl)methyl]benzamide
Names & synonyms
SCHEMBL4006291PICJCWHZRLHLNR-UHFFFAOYSA-N4-(3-Chloro-indazole-1-sulfonyl)-N-(4-fluoro-benzyl)-benzamide
Database identifiers
- PubChem CID
- 58975152
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 89.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 703
Related reactions
9 records
Compound notes
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