tert-butyl 1-(1-(3-cyanopyridin-2-yl)-1H-benzo[d]imidazol-2-yl)piperidin-4-ylcarbamate
Basic information
- CAS
1146080-31-0- Standard SMILES
CC(C)(C)OC(=O)NC1CCN(c2nc3ccccc3n2-c2ncccc2C#N)CC1- InChIKey
IZNOHABSQYHCFH-UHFFFAOYSA-N- Molecular formula
- C23H26N6O2
- Average molar mass
- 418.5 g/mol
- Monoisotopic mass
- 418.21172409
Names & identifiers
- Preferred name
- tert-butyl 1-(1-(3-cyanopyridin-2-yl)-1H-benzo[d]imidazol-2-yl)piperidin-4-ylcarbamate
- IUPAC
- tert-butyl N-[1-[1-(3-cyano-2-pyridinyl)benzimidazol-2-yl]piperidin-4-yl]carbamate
- English name
- 2-Chloro-1-(5-nitro-pyridin-2-yl)-1H-benzoiMidazole, 98+%
- Molecular formula
- C12H7ClN4O2
- Molecular weight
- 274.66
Names & synonyms
tert-butyl1-(1-(3-cyanopyridin-2-yl)-1H-benzo[d]imidazol-2-yl)piperidin-4-ylcarbamatetert-butyl 1-(1-(3-cyanopyridin-2-yl)-1H-benzo[d]imidazol-2-yl)piperidin-4-ylcarbamateDTXSID10733675SBB075718AKOS0159416131314353-39-3DB-257036(tert-butoxy)-N-{1-[1-(3-cyano(2-pyridyl))benzimidazol-2-yl](4-piperidyl)}carb oxamidetert-Butyl {1-[1-(3-cyanopyridin-2-yl)-1H-1,3-benzimidazol-2-yl]piperidin-4-yl}carbamatetert-Butyl {1-[1-(3-cyanopyridin-2-yl)-1H-benzimidazol-2-yl]piperidin-4-yl}carbamate2-Chloro-1-(5-nitro-2-pyridinyl)-1H-benzimidazole1H-Benzimidazole, 2-chloro-1-(5-nitro-2-pyridinyl)-
Show more names
2-Chloro-1-(5-nitropyridin-2-yl)-1H-benzo[d]iMidazole2-Chloro-1-(5-nitro-pyridin-2-yl)-1H-benzoiMidazole, 98+%
Database identifiers
- CAS
1146080-31-0- PubChem CID
- 60137752
- DTXSID
DTXSID10733675
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 96.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 677
Physicochemical properties
- Density
- 1.56 · 1.56
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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