Basic information
- CAS
720678-15-9- Standard SMILES
Fc1ccccc1-c1nc(-c2ccncc2)ncc1-c1nnnn1-c1ccccc1- InChIKey
LMUOQUVYRBQCLB-UHFFFAOYSA-N- Molecular formula
- C22H14FN7
- Average molar mass
- 395.4 g/mol
- Monoisotopic mass
- 395.12947164
Names & identifiers
- Preferred name
- 4-(2-Fluorophenyl)-5-(1-phenyltetrazol-5-yl)-2-pyridin-4-ylpyrimidine
- IUPAC
- 4-(2-fluorophenyl)-5-(1-phenyltetrazol-5-yl)-2-pyridin-4-ylpyrimidine
- English name
- 4-(2-fluorophenyl)-5-(1-phenyl-1H-tetraazol-5-yl)-2-(4-pyridinyl)pyrimidine
- Molecular formula
- C22H14FN7
- Molecular weight
- 395.3918632
Names & synonyms
4-(2-fluorophenyl)-5-(1-phenyl-1H-tetraazol-5-yl)-2-(4-pyridinyl)pyrimidine4-(2-fluorophenyl)-5-(1-phenyltetrazol-5-yl)-2-pyridin-4-ylpyrimidineAKOS024386815ST51038810AG-401/428738525-[4-(2-fluorophenyl)-2-(4-pyridyl)pyrimidin-5-yl]-1-phenyl-1,2,3,4-tetraazole
Database identifiers
- CAS
720678-15-9- PubChem CID
- 1046858
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 82.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 540
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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