Basic information
- Standard SMILES
Cc1cccc(-c2sc(C)nc2C(=O)N2CC3CC3C2CNC(=O)c2ccc(F)cc2Cl)c1- InChIKey
ISHHSTAPRSERNY-UHFFFAOYSA-N- Molecular formula
- C25H23ClFN3O2S
- Average molar mass
- 484 g/mol
Names & identifiers
- Preferred name
- 2-chloro-4-fluoro-N-[[3-[2-methyl-5-(3-methylphenyl)-1,3-thiazole-4-carbonyl]-3-azabicyclo[3.1.0]hexan-2-yl]methyl]benzamide
- IUPAC
- 2-chloro-4-fluoro-N-[[3-[2-methyl-5-(3-methylphenyl)-1,3-thiazole-4-carbonyl]-3-azabicyclo[3.1.0]hexan-2-yl]methyl]benzamide
Names & synonyms
SCHEMBL2931151
Database identifiers
- PubChem CID
- 68445481
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 759
Related reactions
1 records
Compound notes
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