Basic information
- Standard SMILES
O=C(Nc1ncc(Br)s1)C12CC3CC(CC(C3)C1)C2- InChIKey
HISZYEFPVDPBHM-UHFFFAOYSA-N- Molecular formula
- C14H17BrN2OS
- Average molar mass
- 341.27 g/mol
- Monoisotopic mass
- 340.0245
Names & identifiers
- Preferred name
- N-(5-bromo-1,3-thiazol-2-yl)adamantane-1-carboxamide
- IUPAC
- N-(5-bromo-1,3-thiazol-2-yl)adamantane-1-carboxamide
Names & synonyms
SCHEMBL962327HISZYEFPVDPBHM-UHFFFAOYSA-NAKOS008978503N-(5-bromo-1,3-thiazol-2-yl)adamantane-1-carboxamideAdamantane-1-carboxylic acid (5-bromo-thiazol-2-yl)-amideAdamantane-1-carboxylic acid (5-bromothiazol-2-yl)-amide
Database identifiers
- PubChem CID
- 49760640
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 362
Related reactions
10 records
Linked notes
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