Basic information
- Standard SMILES
CON=C(c1ccc(F)cc1)c1nc(Nc2cc(C)[nH]n2)c2ccccc2n1- InChIKey
MKUJNDVSANVIMU-UHFFFAOYSA-N- Molecular formula
- C20H17FN6O
- Average molar mass
- 376.4 g/mol
- Monoisotopic mass
- 376.14478735
Names & identifiers
- Preferred name
- (4-fluorophenyl)(4-(5-methyl-1H-pyrazol-3-ylamino)quinazolin-2-yl)methanone O-methyloxime
- IUPAC
- 2-[C-(4-fluorophenyl)-N-methoxycarbonimidoyl]-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine
Names & synonyms
SCHEMBL174814MKUJNDVSANVIMU-UHFFFAOYSA-N(4-fluorophenyl)(4-(5-methyl-1H-pyrazol-3-ylamino)quinazolin-2-yl)methanone O-methyloxime
Database identifiers
- PubChem CID
- 86649059
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 541
Related reactions
4 records
Compound notes
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