Basic information
- Standard SMILES
COC(OC)c1cnc(NC(=O)C(CC2CCCC2)c2ccc(S(C)(=O)=O)c(Cl)c2)cn1- InChIKey
ZRXYEXRHPSYMDY-UHFFFAOYSA-N- Molecular formula
- C22H28ClN3O5S
- Average molar mass
- 482 g/mol
Names & identifiers
- Preferred name
- 2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[5-(dimethoxymethyl)pyrazin-2-yl]propanamide
- IUPAC
- 2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[5-(dimethoxymethyl)pyrazin-2-yl]propanamide
Names & synonyms
SCHEMBL2645846
Database identifiers
- PubChem CID
- 21897230
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 709
Related reactions
1 records
Compound notes
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