8-(p-Chlorophenylsulfonamido)-4-[3-(3-pyridyl)-2-propenyl]-octanoic acid
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Basic information
- Standard SMILES
O=C(O)CCC(CC=Cc1cccnc1)CCCCNS(=O)(=O)c1ccc(Cl)cc1- InChIKey
AUCZLPCNGAISOP-UHFFFAOYSA-N- Molecular formula
- C22H27ClN2O4S
- Average molar mass
- 451 g/mol
Names & identifiers
- Preferred name
- 8-(p-Chlorophenylsulfonamido)-4-[3-(3-pyridyl)-2-propenyl]-octanoic acid
- IUPAC
- 8-[(4-chlorophenyl)sulfonylamino]-4-(3-pyridin-3-ylprop-2-enyl)octanoic acid
Names & synonyms
SCHEMBL9732152AUCZLPCNGAISOP-UHFFFAOYSA-N8-(p-chlorophenylsulfonamido)-4-[3-(3-pyridyl)-2-propenyl]-octanoic acid8-(p-chlorophenylsulfonamido)-4-[3-(3-pyridyl)-2-propenyl]octanoic acid
Database identifiers
- PubChem CID
- 53662270
Properties
Computed structural propertiesFilling in
- XLogP
- 4.4
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 628
Related reactions
3 records
Compound notes
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