Basic information
- Standard SMILES
Cc1nc2sccn2c1C(=O)NC[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)c1ccccc1-c1ccc(F)cc1- InChIKey
QGHOYNUFDNFPGJ-NGYIFUPDSA-N- Molecular formula
- C28H27FN4O2S
- Average molar mass
- 502.6 g/mol
- Monoisotopic mass
- 502.18387545
Names & identifiers
- Preferred name
- 6-Methyl-imidazo[2,1-b]thiazole-5-carboxylic acid-(1S,2S,5R)-[3-(4'-fluoro-biphenyl-2-carbonyl)-3-aza-bicyclo[3.3.0]oct-2-ylmethyl]-amide
- IUPAC
- N-[[(3S,3aS,6aR)-2-[2-(4-fluorophenyl)benzoyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-3-yl]methyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide
Names & synonyms
SCHEMBL496347QGHOYNUFDNFPGJ-NGYIFUPDSA-N6-Methyl-imidazo[2,1-b]thiazole-5-carboxylic acid-(1S,2S,5R)-[3-(4'-fluoro-biphenyl-2-carbonyl)-3-aza-bicyclo[3.3.0]oct-2-ylmethyl]-amide
Database identifiers
- PubChem CID
- 25154657
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 95 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 823
Related reactions
1 records
Compound notes
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