N-[5-(3,5-difluorobenzyl)-1H-indazol-3-yl]-4-{[(2S)-1-methylpyrrolidin-2-yl]methoxy}-2-(tetrahydro-2H-pyran-4-ylamino)benzamide

HCID 59577333

Basic information

Standard SMILES
CN1CCC[C@H]1COc1ccc(C(=O)Nc2n[nH]c3ccc(Cc4cc(F)cc(F)c4)cc23)c(NC2CCOCC2)c1
InChIKey
WQSSWQONCSNBEL-VWLOTQADSA-N
Molecular formula
C32H35F2N5O3
Average molar mass
575.6 g/mol

Names & identifiers

Preferred name
N-[5-(3,5-difluorobenzyl)-1H-indazol-3-yl]-4-{[(2S)-1-methylpyrrolidin-2-yl]methoxy}-2-(tetrahydro-2H-pyran-4-ylamino)benzamide
IUPAC
N-[5-[(3,5-difluorophenyl)methyl]-1H-indazol-3-yl]-4-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-2-(oxan-4-ylamino)benzamide

Names & synonyms

SCHEMBL3513528WQSSWQONCSNBEL-VWLOTQADSA-NN-[5-(3,5-difluorobenzyl)-1H-indazol-3-yl]-4-{[(2S)-1-methylpyrrolidin-2-yl]methoxy}-2-(tetrahydro-2H-pyran-4-ylamino)benzamide

Database identifiers

PubChem CID
59577333

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
91.5 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
42

Related reactions

6 records

Compound notes

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