Basic information
- Standard SMILES
COC(Cc1ccc(NC2CCN(c3ccc(S(=O)(=O)N4CCCCC4)cc3)CC2)cc1)OC- InChIKey
TWPNOVIXYRRGPV-UHFFFAOYSA-N- Molecular formula
- C26H37N3O4S
- Average molar mass
- 487.7 g/mol
Names & identifiers
- Preferred name
- N-[4-(2,2-Dimethoxyethyl)phenyl]-1-[4-(1-piperidinylsulfonyl)phenyl]-4-piperidinamine
- IUPAC
- N-[4-(2,2-dimethoxyethyl)phenyl]-1-(4-piperidin-1-ylsulfonylphenyl)piperidin-4-amine
Names & synonyms
SCHEMBL7095485TWPNOVIXYRRGPV-UHFFFAOYSA-NN-[4-(2,2-Dimethoxyethyl)phenyl]-1-[4-(1-piperidinylsulfonyl)phenyl]-4-piperidinamine
Database identifiers
- PubChem CID
- 18173830
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 681
Related reactions
2 records
Compound notes
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