2-(5-(difluoromethoxy)-1-(3-(dimethylamino)propyl)-1H-indazol-3-yl)-N-(1-methylcyclopropyl)-5-trityl-5H-pyrrolo[3,2-b]pyrazine-7-carboxamide (HCID 71280669)

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Basic information

Standard SMILES: CN(C)CCCn1nc(-c2cnc3c(n2)c(C(=O)NC2(C)CC2)cn3C(c2ccccc2)(c2ccccc2)c2ccccc2)c2cc(OC(F)F)ccc21
InChIKey: FLBZALRPJRLRNK-UHFFFAOYSA-N
Molecular formula: C43H41F2N7O2
Average molar mass: 725.8 g/mol

Names & identifiers

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

Names & synonyms

2-(5-(difluoromethoxy)-1-(3-(dimethylamino)propyl)-1H-indazol-3-yl)-N-(1-methylcyclopropyl)-5-trityl-5H-pyrrolo[3,2-b]pyrazine-7-carboxamideSCHEMBL14738813

Database identifiers

PubChem CID: 71280669

Properties

Computed structural properties

XLogP: 7.7
Topological polar surface area: 90.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 8
Rotatable bonds: 13
Heavy atoms: 54
Formal charge: 0
Complexity: 1,190

Related reactions

2 records

New reaction record

HRID 246747As productuspto-grants-2014_02

HRID 246748As reactantuspto-grants-2014_02

Compound notes

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