Basic information
- Standard SMILES
COc1ccc(-c2cnc(N3CC4CC5CC3CN(C5)C4)s2)cc1- InChIKey
PUKDMCGPIQUYKV-UHFFFAOYSA-N- Molecular formula
- C19H23N3OS
- Average molar mass
- 341.5 g/mol
Names & identifiers
- Preferred name
- 4-[5-(4-Methoxyphenyl)-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-(4-methoxyphenyl)-1,3-thiazole
Names & synonyms
PUKDMCGPIQUYKV-UHFFFAOYSA-N4-[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1,4-diazatricyclo[4.3.1.13,8]undecane
Database identifiers
- PubChem CID
- 86649261
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 456
Related reactions
1 records
Compound notes
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