N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]adamantane-1-carboxamide
Basic information
- CAS
5698-46-4- Standard SMILES
Cc1ccc(-c2csc(NC(=O)C34CC5CC(CC(C5)C3)C4)n2)cc1- InChIKey
QWKLZPCWNQGHRY-UHFFFAOYSA-N- Molecular formula
- C21H24N2OS
- Average molar mass
- 352.5 g/mol
- Monoisotopic mass
- 352.16093457
Names & identifiers
- Preferred name
- N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]adamantane-1-carboxamide
- IUPAC
- N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]adamantane-1-carboxamide
Names & synonyms
5698-46-4N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1-adamantanecarboxamideN-[4-(4-methylphenyl)-1,3-thiazol-2-yl]adamantane-1-carboxamideST50915340CDS1_004466CBMicro_030130Oprea1_268647Oprea1_586578Oprea1_735117DivK1c_005506DTXSID30386420STK401531
Show more names
AKOS001081846N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamideNCGC00323269-01BIM-0030166.P001AB01229583-03AE-848/11905031Z27854442adamantanyl-N-[4-(4-methylphenyl)(1,3-thiazol-2-yl)]carboxamide
Database identifiers
- CAS
5698-46-4- PubChem CID
- 2862671
- DTXSID
DTXSID30386420
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 487
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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