Basic information
- Standard SMILES
CC1=NC2(N=C1N)c1cc(-c3cncc(Cl)c3)ccc1CC21CCC(C(F)F)CC1- InChIKey
YGKQMZYHQKDGRZ-UHFFFAOYSA-N- Molecular formula
- C23H23ClF2N4
- Average molar mass
- 428.9 g/mol
Names & identifiers
- Preferred name
- 6'-(5-Chloropyridin-3-yl)-4-(difluoromethyl)-5''-methyl-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-imidazol]-4''-amine
Names & synonyms
6'-(5-Chloropyridin-3-yl)-4-(difluoromethyl)-5''-methyl-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-imidazol]-4''-amineSCHEMBL9948002CHEMBL3657445BDBM136904US8865911, 129
Database identifiers
- PubChem CID
- 67979384
- ChEMBL
CHEMBL3657445
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 733
Related reactions
3 records
Compound notes
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