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Basic information
- Standard SMILES
COc1ccc(NC(=O)N(C)c2cc(Nc3ccc(F)cc3)ncn2)cc1- InChIKey
UVQNKFOXOMALJK-UHFFFAOYSA-N- Molecular formula
- C19H18FN5O2
- Average molar mass
- 367.4 g/mol
- Monoisotopic mass
- 367.144453
Names & identifiers
- Preferred name
- 1-[6-(4-Fluoro-Phenylamino)-pyrimidin-4-yl]-3-(4-methoxy-phenyl)-1-methyl-urea
- IUPAC
- 1-[6-(4-fluoroanilino)pyrimidin-4-yl]-3-(4-methoxyphenyl)-1-methylurea
Names & synonyms
SCHEMBL374352UVQNKFOXOMALJK-UHFFFAOYSA-N1-[6-(4-Fluoro-Phenylamino)-pyrimidin-4-yl]-3-(4-methoxy-phenyl)-1-methyl-urea
Database identifiers
- PubChem CID
- 57710409
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 467
Related reactions
2 records
Compound notes
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