Basic information
- Standard SMILES
Cl.NC1=Nc2ccc(F)cc2Nc2ccc(C(F)(F)F)cc21- InChIKey
YPKSZWREUOGPJZ-UHFFFAOYSA-N- Molecular formula
- C14H10ClF4N3
- Average molar mass
- 331.69 g/mol
- Monoisotopic mass
- 331.0499377
Names & identifiers
- Preferred name
- 7-Fluoro-2-trifluoromethyl-5H-dibenzo[b,e][1,4]diazepin-11-ylamine hydrochloride
- IUPAC
- 2-fluoro-8-(trifluoromethyl)-11H-benzo[b][1,4]benzodiazepin-6-amine;hydrochloride
Names & synonyms
7-Fluoro-2-trifluoromethyl-5H-dibenzo[b,e][1,4]diazepin-11-ylamine hydrochlorideSCHEMBL4837164
Database identifiers
- PubChem CID
- 69210778
Properties
Computed structural properties
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 423
Related reactions
2 records
Compound notes
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