4-(4-Methoxy-phenyl)-2-methyl-thiazole-5-carbonitrile
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Basic information
- Standard SMILES
COc1ccc(-c2nc(C)sc2C#N)cc1- InChIKey
MRLZOAOADDQEPT-UHFFFAOYSA-N- Molecular formula
- C12H10N2OS
- Average molar mass
- 230.29 g/mol
Names & identifiers
- Preferred name
- 4-(4-Methoxy-phenyl)-2-methyl-thiazole-5-carbonitrile
- IUPAC
- 4-(4-methoxyphenyl)-2-methyl-1,3-thiazole-5-carbonitrile
Names & synonyms
SCHEMBL202790MRLZOAOADDQEPT-UHFFFAOYSA-N4-(4-Methoxy-phenyl)-2-methyl-thiazole-5-carbonitrile
Database identifiers
- PubChem CID
- 66619952
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 280
Related reactions
3 records
Compound notes
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