1-Methyl-1H-imidazole-2-carboxylicacid[3-(4-amino-pyrazolo[3,4-d]pyrimidin-1-yl)-phenyl]-amide

HCID 57750260
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
Cn1ccnc1C(=O)Nc1cccc(-n2ncc3c(N)ncnc32)c1
InChIKey
JHTCUDSIHAUDAK-UHFFFAOYSA-N
Molecular formula
C16H14N8O
Average molar mass
334.34 g/mol
Monoisotopic mass
334.1290571

Names & identifiers

Preferred name
1-Methyl-1H-imidazole-2-carboxylicacid[3-(4-amino-pyrazolo[3,4-d]pyrimidin-1-yl)-phenyl]-amide
IUPAC
N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-1-methylimidazole-2-carboxamide

Names & synonyms

SCHEMBL3868965JHTCUDSIHAUDAK-UHFFFAOYSA-N1-Methyl-1H-imidazole-2-carboxylicacid[3-(4-amino-pyrazolo[3,4-d]pyrimidin-1-yl)-phenyl]-amide

Database identifiers

PubChem CID
57750260

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
117 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
25

Related reactions

1 records
New reaction record

Compound notes

Loading…