Basic information
- Standard SMILES
CN1Cc2c(Cl)cc(Cl)cc2C(c2ccc(S(=O)(=O)NCCCCNS(=O)(=O)c3ccc(C4CN(C)Cc5c(Cl)cc(Cl)cc54)cc3)cc2)C1- InChIKey
OPWVKBOBJFJYKT-UHFFFAOYSA-N- Molecular formula
- C36H38Cl4N4O4S2
- Average molar mass
- 796.7 g/mol
Names & identifiers
- Preferred name
- N,N'-(butane-1,4-diyl)bis(4-(6,8-dichloro-2-methyl-1,2,3,4-tetrahydroisoquinolin-4-yl)benzenesulfonamide)
- IUPAC
- 4-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)-N-[4-[[4-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl]sulfonylamino]butyl]benzenesulfonamide
Names & synonyms
SCHEMBL2577484OPWVKBOBJFJYKT-UHFFFAOYSA-NN,N'-(butane-1,4-diyl)bis(4-(6,8-dichloro-2-methyl-1,2,3,4-tetrahydroisoquinolin-4-yl)benzenesulfonamide)
Database identifiers
- PubChem CID
- 67459666
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 50
- Formal charge
- 0
- Complexity
- 1,220
Related reactions
4 records
Compound notes
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