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Basic information
- Standard SMILES
Cc1nc(-c2cn3c(n2)-c2ccc(C4CCN(C(C)(C)C(N)=O)CC4)cc2OCC3)n(C(C)C)n1- InChIKey
ILOMLTAEBJUVGT-UHFFFAOYSA-N- Molecular formula
- C26H35N7O2
- Average molar mass
- 477.6 g/mol
- Monoisotopic mass
- 477.28522338
Names & identifiers
- Preferred name
- 2-(4-(2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-9-yl)piperidin-1-yl)-2-methylpropanamide
- IUPAC
- 2-methyl-2-[4-[2-(5-methyl-2-propan-2-yl-1,2,4-triazol-3-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl]piperidin-1-yl]propanamide
Names & synonyms
SCHEMBL11967461ILOMLTAEBJUVGT-UHFFFAOYSA-N2-(4-(2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-9-yl)piperidin-1-yl)-2-methylpropanamide
Database identifiers
- PubChem CID
- 58204530
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 756
Related reactions
6 records
Compound notes
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