Anthranilic acid, N-(3-adamantylacetyl)-
Basic information
- CAS
50741-84-9- Standard SMILES
O=C(CC12CC3CC(CC(C3)C1)C2)Nc1ccccc1C(=O)O- InChIKey
DRIJZVBQIBQALY-UHFFFAOYSA-N- Molecular formula
- C19H23NO3
- Average molar mass
- 313.4 g/mol
- Monoisotopic mass
- 313.1677936
Names & identifiers
- Preferred name
- Anthranilic acid, N-(3-adamantylacetyl)-
- IUPAC
- 2-[[2-(1-adamantyl)acetyl]amino]benzoic acid
Names & synonyms
N-(3-Adamantylacetyl)anthranilic acid50741-84-9BRN 2880584Anthranilic acid, N-(3-adamantylacetyl)-DTXSID101987852-((Tricyclo(3.3.1.1(sup 3,7))dec-1-ylacetyl)amino)benzoic acidBenzoic acid, 2-((tricyclo(3.3.1.1(sup 3,7))dec-1-ylacetyl)amino)-RefChem:319810DTXCID701212762-[2-(ADAMANTAN-1-YL)ACETAMIDO]BENZOIC ACID
Database identifiers
- CAS
50741-84-9- PubChem CID
- 64361
- DTXSID
DTXSID10198785
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 460
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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