Basic information
- Standard SMILES
CC1(C)CCC(C)(C)c2cc(-c3csc(N4CCCNCC4)n3)ccc21- InChIKey
FLHQPQUWPBCWAO-UHFFFAOYSA-N- Molecular formula
- C22H31N3S
- Average molar mass
- 369.6 g/mol
Names & identifiers
- Preferred name
- 1-[4-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)thiazol-2-yl]-1,4-diazepane
- IUPAC
- 2-(1,4-diazepan-1-yl)-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazole
Names & synonyms
SCHEMBL2223014FLHQPQUWPBCWAO-UHFFFAOYSA-N1-[4-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)thiazol-2-yl]-1,4-diazepane
Database identifiers
- PubChem CID
- 53311543
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 56.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 492
Related reactions
3 records
Compound notes
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