HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-(2-(4-(7-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl)-1H-pyrazol-1-yl)spiro[3.3]heptan-2-yl)acetonitrile

HCID 67456928
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cn1cc(-c2cc3nccn3c(-c3cnn(C4(CC#N)CC5(CCC5)C4)c3)n2)cn1
InChIKey
BZAFTCVZFVIBLM-UHFFFAOYSA-N
Molecular formula
C22H22N8
Average molar mass
398.5 g/mol

Names & identifiers

Preferred name
2-(2-(4-(7-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl)-1H-pyrazol-1-yl)spiro[3.3]heptan-2-yl)acetonitrile
IUPAC
2-[2-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]pyrazol-1-yl]spiro[3.3]heptan-2-yl]acetonitrile

Names & synonyms

SCHEMBL2571674BZAFTCVZFVIBLM-UHFFFAOYSA-N2-(2-(4-(7-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl)-1H-pyrazol-1-yl)spiro[3.3]heptan-2-yl)acetonitrile

Database identifiers

PubChem CID
67456928

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
89.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
30
Formal charge
0
Complexity
705

Related reactions

1 records
New reaction record
HRID 1853088 reaction equation
HRID 1853088As productuspto-grants-2015_02

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes