Basic information
- Standard SMILES
Cc1cccc(-c2cnc(N3CC4CC5CC3CN(C5)C4)s2)c1- InChIKey
KWRIOEIZWGBFLY-UHFFFAOYSA-N- Molecular formula
- C19H23N3S
- Average molar mass
- 325.5 g/mol
Names & identifiers
- Preferred name
- 4-[5-(3-Methylphenyl)-1,3-thiazol-2-yl]-1,4-diazatricyclo[4.3.1.13,8]undecane
- IUPAC
- 2-(1,4-diazatricyclo[4.3.1.13,8]undecan-4-yl)-5-(3-methylphenyl)-1,3-thiazole
Names & synonyms
KWRIOEIZWGBFLY-UHFFFAOYSA-N4-[5-(3-methylphenyl)-1,3-thiazol-2-yl]-1,4-diazatricyclo[4.3.1.13,8]undecane
Database identifiers
- PubChem CID
- 86649264
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 444
Related reactions
1 records
Compound notes
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