Basic information
- CAS
943425-94-3- Standard SMILES
NC(=O)c1ccc(-c2ncc(-c3nnnn3-c3ccc(F)cc3)c(C(F)(F)F)n2)cc1- InChIKey
YJJRGYYSJMQFMC-UHFFFAOYSA-N- Molecular formula
- C19H11F4N7O
- Average molar mass
- 429.3 g/mol
Names & identifiers
- Preferred name
- 4-[5-[1-(4-fluorophenyl)-1H-tetraazol-5-yl]-4-(trifluoromethyl)-2-pyrimidinyl]benzamide
- IUPAC
- 4-[5-[1-(4-fluorophenyl)tetrazol-5-yl]-4-(trifluoromethyl)pyrimidin-2-yl]benzamide
- English name
- 4-[5-[1-(4-fluorophenyl)-1H-tetraazol-5-yl]-4-(trifluoromethyl)-2-pyrimidinyl]benzamide
- Molecular formula
- C19H11F4N7O
- Molecular weight
- 429.3305528
Names & synonyms
4-[5-[1-(4-fluorophenyl)-1H-tetraazol-5-yl]-4-(trifluoromethyl)-2-pyrimidinyl]benzamideAKOS024387084ST51039241AG-401/433641344-[5-[1-(4-fluorophenyl)tetrazol-5-yl]-4-(trifluoromethyl)pyrimidin-2-yl]benzamide4-{5-[1-(4-fluorophenyl)(1,2,3,4-tetraazol-5-yl)]-4-(trifluoromethyl)pyrimidin -2-yl}benzamide
Database identifiers
- CAS
943425-94-3
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 623
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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