N-(3-(1H-benzo[d]imidazol-2-yl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-5-yl)-3-fluorobenzamide
Basic information
- Standard SMILES
O=C(Nc1ccc2c(c1)c(-c1nc3ccccc3[nH]1)nn2C1CCCCO1)c1cccc(F)c1- InChIKey
KJTDBMCUQIVFEI-UHFFFAOYSA-N- Molecular formula
- C26H22FN5O2
- Average molar mass
- 455.5 g/mol
- Monoisotopic mass
- 455.17575312
Names & identifiers
- Preferred name
- N-(3-(1H-benzo[d]imidazol-2-yl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-5-yl)-3-fluorobenzamide
- IUPAC
- N-[3-(1H-benzimidazol-2-yl)-1-(oxan-2-yl)indazol-5-yl]-3-fluorobenzamide
Names & synonyms
SCHEMBL12813372KJTDBMCUQIVFEI-UHFFFAOYSA-NN-(3-(1H-benzo[d]imidazol-2-yl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-5-yl)-3-fluorobenz amideN-(3-(1H-benzo[d]imidazol-2-yl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-5-yl)-3-fluorobenzamide
Database identifiers
- PubChem CID
- 136352248
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 84.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 727
Related reactions
4 records
Compound notes
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