N-tert-butyl-2-(5-(difluoromethoxy)-1H-indazol-3-yl)-5-trityl-5H-pyrrolo[3,2-b]pyrazine-7-carboxamide

HCID 71279313
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Basic information

Standard SMILES
CC(C)(C)NC(=O)c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c2ncc(-c3n[nH]c4ccc(OC(F)F)cc34)nc12
InChIKey
APSDQPSXXOKCDY-UHFFFAOYSA-N
Molecular formula
C38H32F2N6O2
Average molar mass
642.7 g/mol

Names & identifiers

Preferred name
N-tert-butyl-2-(5-(difluoromethoxy)-1H-indazol-3-yl)-5-trityl-5H-pyrrolo[3,2-b]pyrazine-7-carboxamide
IUPAC
N-tert-butyl-2-[5-(difluoromethoxy)-1H-indazol-3-yl]-5-tritylpyrrolo[2,3-b]pyrazine-7-carboxamide

Names & synonyms

N-tert-butyl-2-(5-(difluoromethoxy)-1H-indazol-3-yl)-5-trityl-5H-pyrrolo[3,2-b]pyrazine-7-carboxamideSCHEMBL14736829

Database identifiers

PubChem CID
71279313

Properties

Computed structural properties

XLogP
7.6
Topological polar surface area
97.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
48

Related reactions

6 records
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Compound notes

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