2-((2-Chloro-5-(difluoromethoxy)-3-(3-(4-methylpiperazin-1-yl)azetidin-1-yl)phenyl)amino)-4-(cyclopropyl(4-methoxybenzyl)amino)imidazo[2,1-f][1,2,4]triazine-7-carbonitrile
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Basic information
- Standard SMILES
COc1ccc(CN(c2nc(Nc3cc(OC(F)F)cc(N4CC(N5CCN(C)CC5)C4)c3Cl)nn3c(C#N)cnc23)C2CC2)cc1- InChIKey
HTZRQFHKYQYAFG-UHFFFAOYSA-N- Molecular formula
- C32H35ClF2N10O2
- Average molar mass
- 665.1 g/mol
Names & identifiers
- Preferred name
- 2-((2-Chloro-5-(difluoromethoxy)-3-(3-(4-methylpiperazin-1-yl)azetidin-1-yl)phenyl)amino)-4-(cyclopropyl(4-methoxybenzyl)amino)imidazo[2,1-f][1,2,4]triazine-7-carbonitrile
- IUPAC
- 2-[2-chloro-5-(difluoromethoxy)-3-[3-(4-methylpiperazin-1-yl)azetidin-1-yl]anilino]-4-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]imidazo[2,1-f][1,2,4]triazine-7-carbonitrile
Names & synonyms
2-((2-Chloro-5-(difluoromethoxy)-3-(3-(4-methylpiperazin-1-yl)azetidin-1-yl)phenyl)amino)-4-(cyclopropyl(4-methoxybenzyl)amino)imidazo[2,1-f][1,2,4]triazine-7-carbonitrileSCHEMBL15409109
Database identifiers
- PubChem CID
- 89919901
Properties
Computed structural propertiesFilling in
- XLogP
- 5.4
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 11
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 1,080
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Related reactions
1 records
Compound notes
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