Basic information
- Standard SMILES
Cc1nc(NC(=O)c2c(F)cccc2F)sc1-c1cc(C#N)c2c(c1)OCO2- InChIKey
ZGQUIBYTJLLUPE-UHFFFAOYSA-N- Molecular formula
- C19H11F2N3O3S
- Average molar mass
- 399.4 g/mol
- Monoisotopic mass
- 399.04891872
Names & identifiers
- Preferred name
- N-(5-(7-Cyanobenzo[d][1,3]dioxol-5-yl)-4-methylthiazol-2-yl)-2,6-difluorobenzamide
- IUPAC
- N-[5-(7-cyano-1,3-benzodioxol-5-yl)-4-methyl-1,3-thiazol-2-yl]-2,6-difluorobenzamide
Names & synonyms
SCHEMBL5048896ZGQUIBYTJLLUPE-UHFFFAOYSA-NN-(5-(7-Cyanobenzo[d][1,3]dioxol-5-yl)-4-methylthiazol-2-yl)-2,6-difluorobenzamide
Database identifiers
- PubChem CID
- 24765407
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 637
Related reactions
1 records
Compound notes
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