Basic information
- Standard SMILES
Cc1nc(-c2cccc(Nc3nccc(=O)[nH]3)c2)cs1- InChIKey
CCFJYCNNNMNBQV-UHFFFAOYSA-N- Molecular formula
- C14H12N4OS
- Average molar mass
- 284.34 g/mol
- Monoisotopic mass
- 284.07318219
Names & identifiers
- Preferred name
- 2-(3-(2-methylthiazol-4-yl)phenylamino)pyrimidin-4(3H)-one
- IUPAC
- 2-[3-(2-methyl-1,3-thiazol-4-yl)anilino]-1H-pyrimidin-6-one
Names & synonyms
SCHEMBL3439839CCFJYCNNNMNBQV-UHFFFAOYSA-N2-(3-(2-methylthiazol-4-yl)phenylamino)pyrimidin-4(3H)-one
Database identifiers
- PubChem CID
- 57780911
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 94.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 437
Related reactions
4 records
Linked notes
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