Basic information
- Standard SMILES
Cc1ccn(-c2ccc(C(=O)N3Cc4cccnc4Oc4ccccc43)c(C(F)(F)F)c2)n1- InChIKey
YVNSDRCAALENIW-UHFFFAOYSA-N- Molecular formula
- C24H17F3N4O2
- Average molar mass
- 450.4 g/mol
Names & identifiers
- Preferred name
- [4-(3-Methyl-pyrazol-1-yl)-2-trifluoromethyl-phenyl]-(11H-5-oxa-4,10-diaza-dibenzo[a,d]cyclohepten-10-yl)-methanone
- IUPAC
- [4-(3-methylpyrazol-1-yl)-2-(trifluoromethyl)phenyl]-(5H-pyrido[2,3-b][1,5]benzoxazepin-6-yl)methanone
Names & synonyms
[4-(3-Methyl-pyrazol-1-yl)-2-trifluoromethyl-phenyl]-(11H-5-oxa-4,10-diaza-dibenzo[a,d]cyclohepten-10-yl)-methanoneSCHEMBL6616508
Database identifiers
- PubChem CID
- 9868370
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 60.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 708
Related reactions
3 records
Compound notes
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