Basic information
- Standard SMILES
Cc1cccc(-c2sc(C)nc2C(=O)N2C[C@@H]3C[C@@H]3[C@H]2CNC(=O)c2cn(C)nc2C)c1- InChIKey
JUZYMXPPHSXCAN-CMKODMSKSA-N- Molecular formula
- C24H27N5O2S
- Average molar mass
- 449.6 g/mol
Names & identifiers
- Preferred name
- 1,3-Dimethyl-1h-pyrazole-4-carboxylic acid[(1s,2s,5r)-3-(2-methyl-5-m-tolyl-thiazole-4-carbonyl)-3-aza-bicyclo[3.1.0]hex-2-ylmethyl]-amide
- IUPAC
- 1,3-dimethyl-N-[[(1S,2S,5R)-3-[2-methyl-5-(3-methylphenyl)-1,3-thiazole-4-carbonyl]-3-azabicyclo[3.1.0]hexan-2-yl]methyl]pyrazole-4-carboxamide
Names & synonyms
SCHEMBL1338268JUZYMXPPHSXCAN-CMKODMSKSA-N1,3-dimethyl-1h-pyrazole-4-carboxylic acid[(1s,2s,5r)-3-(2-methyl-5-m-tolyl-thiazole-4-carbonyl)-3-aza-bicyclo[3.1.0]hex-2-ylmethyl]-amide
Database identifiers
- PubChem CID
- 25181710
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 737
Related reactions
1 records
Compound notes
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