Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
Cc1ccc(-n2cc(CO)nn2)cc1C(=O)c1ccc(Nc2ccc(F)cc2F)cc1Cl- InChIKey
GOQTTZHMKGKNCG-UHFFFAOYSA-N- Molecular formula
- C23H17ClF2N4O2
- Average molar mass
- 454.9 g/mol
- Monoisotopic mass
- 454.1008098
Names & identifiers
- Preferred name
- [2-Chloro-4-(2,4-difluoro-phenylamino)-phenyl]-[5-(4-hydroxymethyl-[1,2,3]triazol-1-yl)-2-methyl-phenyl]-methanone
- IUPAC
- [2-chloro-4-(2,4-difluoroanilino)phenyl]-[5-[4-(hydroxymethyl)triazol-1-yl]-2-methylphenyl]methanone
Names & synonyms
SCHEMBL2852365GOQTTZHMKGKNCG-UHFFFAOYSA-N[2-Chloro-4-(2,4-difluoro-phenylamino)-phenyl]-[5-(4-hydroxymethyl-[1,2,3]triazol-1-yl)-2-methyl-phenyl]-methanone
Database identifiers
- PubChem CID
- 11633875
Properties
Computed structural propertiesFilling in
- XLogP
- 4.6
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 647
Related reactions
1 records
Compound notes
Loading…