Basic information
- Standard SMILES
O=C(NCC1CC1c1ccccc1)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nn1- InChIKey
FNQOCOGXHLMBKB-UHFFFAOYSA-N- Molecular formula
- C27H26F3N5O2
- Average molar mass
- 509.5 g/mol
Names & identifiers
- Preferred name
- 6-[4-(2-TRIFLUOROMETHYLBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (2-PHENYLCYCLOPROPYLMETHYL)AMIDE
- IUPAC
- N-[(2-phenylcyclopropyl)methyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide
Names & synonyms
6-[4-(2-TRIFLUOROMETHYLBENZOYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (2-PHENYLCYCLOPROPYLMETHYL)AMIDESCHEMBL1379082
Database identifiers
- PubChem CID
- 11295159
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 797
Related reactions
5 records
Compound notes
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