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Basic information
- Standard SMILES
CC(C)(C)OC(=O)NCc1ccc(-c2nc3c(N4CCC(Cc5ccccc5)CC4)c(Br)cnc3[nH]2)cc1- InChIKey
TYAIQZRMRQXQQC-UHFFFAOYSA-N- Molecular formula
- C30H34BrN5O2
- Average molar mass
- 576.5 g/mol
- Monoisotopic mass
- 575.18959
Names & identifiers
- Preferred name
- tert-butyl 4-(7-(4-benzylpiperidin-1-yl)-6-bromo-3H-imidazo[4,5-b]pyridin-2-yl)benzylcarbamate
- IUPAC
- tert-butyl N-[[4-[7-(4-benzylpiperidin-1-yl)-6-bromo-1H-imidazo[4,5-b]pyridin-2-yl]phenyl]methyl]carbamate
Names & synonyms
SCHEMBL210988TYAIQZRMRQXQQC-UHFFFAOYSA-Ntert-butyl 4-(7-(4-benzylpiperidin-1-yl)-6-bromo-3H-imidazo[4,5-b]pyridin-2-yl)benzylcarbamate
Database identifiers
- PubChem CID
- 57897223
Properties
Computed structural propertiesFilling in
- XLogP
- 6.4
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 756
Related reactions
3 records
Compound notes
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