N-[2-(4-(3-hydroxy-1-adamantylcarbonylamino)-1-piperidinyl)ethyl]-1-(2-propyl)-1H-indazole-3-carboxamide oxalate

HCID 18969239
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Basic information

Standard SMILES
CC(C)n1nc(C(=O)NCCN2CCC(NC(=O)C34CC5CC(CC(O)(C5)C3)C4)CC2)c2ccccc21.O=C(O)C(=O)O
InChIKey
VKTGRZSZAVIWTP-UHFFFAOYSA-N
Molecular formula
C31H43N5O7
Average molar mass
597.7 g/mol
Monoisotopic mass
597.31624873

Names & identifiers

Preferred name
N-[2-(4-(3-hydroxy-1-adamantylcarbonylamino)-1-piperidinyl)ethyl]-1-(2-propyl)-1H-indazole-3-carboxamide oxalate
IUPAC
N-[2-[4-[(3-hydroxyadamantane-1-carbonyl)amino]piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide;oxalic acid

Names & synonyms

SCHEMBL7396492VKTGRZSZAVIWTP-UHFFFAOYSA-NN-[2-(4-(3-hydroxy-1-adamantylcarbonylamino)-1-piperidinyl)ethyl]-1-(2-propyl)-1H-indazole-3-carboxamide oxalate

Database identifiers

PubChem CID
18969239

Properties

Computed structural properties

Topological polar surface area
174 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
9
Rotatable bonds
8
Heavy atoms
43

Related reactions

2 records
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Compound notes

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