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Basic information
- Standard SMILES
CC(C)(C)n1nnc(C(CO)=C(c2ccc(F)cc2)c2ccc(F)cc2)n1- InChIKey
YKZSYIMKZNLHAO-UHFFFAOYSA-N- Molecular formula
- C20H20F2N4O
- Average molar mass
- 370.4 g/mol
- Monoisotopic mass
- 370.1605176
Names & identifiers
- Preferred name
- 3,3-Bis(4-fluorophenyl)-2-[2-(1,1-dimethylethyl)-2H-tetrazol-5-yl]-2-propenol
- IUPAC
- 2-(2-tert-butyltetrazol-5-yl)-3,3-bis(4-fluorophenyl)prop-2-en-1-ol
Names & synonyms
SCHEMBL9726744YKZSYIMKZNLHAO-UHFFFAOYSA-N3,3-Bis(4-fluorophenyl)-2-[2(1,1-dimethylethyl)-2H-tetrazol-5-yl]-2-propenol3,3-Bis(4-fluorophenyl)-2-[2-(1,1-dimethylethyl)-2H-tetrazol-5-yl]-2-propenol
Database identifiers
- PubChem CID
- 14723906
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 497
Related reactions
4 records
Compound notes
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