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Basic information
- Standard SMILES
CS(=O)(=O)c1ccc([C@@H](CC2CCC(O)CC2)C(=O)Nc2cnc(Cl)cn2)cc1Cl- InChIKey
QQXUDIFSYPJALF-PESDSKBTSA-N- Molecular formula
- C20H23Cl2N3O4S
- Average molar mass
- 472.4 g/mol
Names & identifiers
- Preferred name
- 2(R)-(3-chloro-4-methanesulfonyl-phenyl)-N-(5-chloro-pyrazin-2-yl)-3-(4-hydroxy-cyclohexyl)-propionamide
- IUPAC
- (2R)-2-(3-chloro-4-methylsulfonylphenyl)-N-(5-chloropyrazin-2-yl)-3-(4-hydroxycyclohexyl)propanamide
Names & synonyms
SCHEMBL2642259QQXUDIFSYPJALF-PESDSKBTSA-N2(R)-(3-chloro-4-methanesulfonyl-phenyl)-N-(5-chloro-pyrazin-2-yl)-3-(4-hydroxy-cyclohexyl)-propionamide
Database identifiers
- PubChem CID
- 10073520
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 682
Related reactions
2 records
Compound notes
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