Basic information
- Standard SMILES
CCOC(=O)C1C(=O)NC(c2ccccn2)=NC1(C)c1ccc(F)cc1F- InChIKey
MBXRHVRSJHSJDY-UHFFFAOYSA-N- Molecular formula
- C19H17F2N3O3
- Average molar mass
- 373.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 4-(2,4-difluorophenyl)-4-methyl-6-oxo-2-(pyridin-2-yl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate
- IUPAC
- ethyl 4-(2,4-difluorophenyl)-4-methyl-6-oxo-2-pyridin-2-yl-1,5-dihydropyrimidine-5-carboxylate
Names & synonyms
SCHEMBL15094892MBXRHVRSJHSJDY-UHFFFAOYSA-Nethyl 4-(2,4-difluorophenyl)-4-methyl-6-oxo-2-(pyridin-2-yl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate
Database identifiers
- PubChem CID
- 89677657
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 80.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 615
Related reactions
1 records
Compound notes
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