Basic information
- CAS
289630-39-3- Standard SMILES
Cc1noc(C)c1C(=O)Nc1ccc2ccccc2c1- InChIKey
NSHVPOJDTHGDMP-UHFFFAOYSA-N- Molecular formula
- C16H14N2O2
- Average molar mass
- 266.29 g/mol
- Monoisotopic mass
- 266.10552769
Names & identifiers
- Preferred name
- 3,5-dimethyl-N-naphthalen-2-yl-1,2-oxazole-4-carboxamide
- IUPAC
- 3,5-dimethyl-N-naphthalen-2-yl-1,2-oxazole-4-carboxamide
Names & synonyms
3,5-dimethyl-N-naphthalen-2-yl-1,2-oxazole-4-carboxamideMLS001071927289630-39-3SMR0006716103,5-dimethyl-N-(naphthalen-2-yl)-1,2-oxazole-4-carboxamidecid_770347CHEMBL1534368BDBM58530DTXSID701323232HMS2994E20STK484729AKOS003397193
Show more names
ST452434883,5-dimethyl-N-(2-naphthyl)isoxazole-4-carboxamideZ28156964(3,5-dimethylisoxazol-4-yl)-N-(2-naphthyl)carboxamide3,5-dimethyl-N-(2-naphthalenyl)-4-isoxazolecarboxamide
Database identifiers
- CAS
289630-39-3- PubChem CID
- 770347
- DTXSID
DTXSID701323232- ChEMBL
CHEMBL1534368
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 360
Experimental & physicochemical properties
Solubility11.2 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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