Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCN(c2ccc3[nH]c(-c4ccc(F)cc4)nc3n2)CC1- InChIKey
DTQSULIFIFLCMJ-UHFFFAOYSA-N- Molecular formula
- C21H24FN5O2
- Average molar mass
- 397.4 g/mol
Names & identifiers
- Preferred name
- 2-(4-Fluorophenyl)-5-(4-tert.butoxycarbonyl-1-piperazinyl)imidazo[4,5-b]pyridine
- IUPAC
- tert-butyl 4-[2-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-5-yl]piperazine-1-carboxylate
Names & synonyms
SCHEMBL6477715DTQSULIFIFLCMJ-UHFFFAOYSA-N2-(4-fluorophenyl)-5-(4-tert.butoxycarbonyl-1-piperazinyl)imidazo[4,5-b]pyridine
Database identifiers
- PubChem CID
- 22486136
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 74.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 570
Related reactions
1 records
Compound notes
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