Basic information
- Standard SMILES
CC#Cc1cc(-c2ccc3c(c2)C2(N=C(C)C(N)=N2)C2(CCC(OC)CC2)C3)ccn1- InChIKey
GHKDKBMFJNPSBF-UHFFFAOYSA-N- Molecular formula
- C26H28N4O
- Average molar mass
- 412.5 g/mol
Names & identifiers
- Preferred name
- 4-Methoxy-5''-methyl-6'-[2-(prop-1-yn-1-yl)pyridin-4-yl]-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-imidazol]-4''-amine
Names & synonyms
SCHEMBL9948542CHEMBL3939422SCHEMBL10253409GHKDKBMFJNPSBF-UHFFFAOYSA-NBDBM136768US8865911, 20y4-Methoxy-5''-methyl-6'-[2-(prop-1-yn-1-yl)pyridin-4-yl]-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-imidazol]-4''-amine
Database identifiers
- PubChem CID
- 67979611
- ChEMBL
CHEMBL3939422
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 827
Related reactions
1 records
Compound notes
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