N-{1-[4-(2-Oxo-2H-pyridin-1-yl)-cyclohexyl]-azetidin-3-yl}-2-(5-trifluoromethyl-1H-indazol-3-ylamino)-acetamide
Basic information
- Standard SMILES
O=C(CNc1n[nH]c2ccc(C(F)(F)F)cc12)NC1CN(C2CCC(n3ccccc3=O)CC2)C1- InChIKey
OWPZOIUERRHILB-UHFFFAOYSA-N- Molecular formula
- C24H27F3N6O2
- Average molar mass
- 488.5 g/mol
Names & identifiers
- Preferred name
- N-{1-[4-(2-Oxo-2H-pyridin-1-yl)-cyclohexyl]-azetidin-3-yl}-2-(5-trifluoromethyl-1H-indazol-3-ylamino)-acetamide
- IUPAC
- N-[1-[4-(2-oxo-1-pyridinyl)cyclohexyl]azetidin-3-yl]-2-[[5-(trifluoromethyl)-1H-indazol-3-yl]amino]acetamide
Names & synonyms
CHEMBL1834636N-{1-[4-(2-Oxo-2H-pyridin-1-yl)-cyclohexyl]-azetidin-3-yl}-2-(5-trifluoromethyl-1H-indazol-3-ylamino)-acetamideSCHEMBL2634347SCHEMBL12050048OWPZOIUERRHILB-HDICACEKSA-NBDBM50355268
Database identifiers
- PubChem CID
- 54755083
- ChEMBL
CHEMBL1834636
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 851
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Related reactions
2 records
Compound notes
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