Basic information
- Standard SMILES
COC(=O)CCCCCCN(Cc1ccc(-c2cnccn2)cc1)S(=O)(=O)c1cccnc1- InChIKey
AFQNVGOHVMTQLN-UHFFFAOYSA-N- Molecular formula
- C24H28N4O4S
- Average molar mass
- 468.6 g/mol
Names & identifiers
- Preferred name
- Methyl 7-[(4-pyrazin-2-ylphenyl)methyl-pyridin-3-ylsulfonylamino]heptanoate
- IUPAC
- methyl 7-[(4-pyrazin-2-ylphenyl)methyl-pyridin-3-ylsulfonylamino]heptanoate
Names & synonyms
SCHEMBL5049389
Database identifiers
- PubChem CID
- 53640407
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 13
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 676
Related reactions
1 records
Compound notes
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