trans-N-methyl-N-[4-(4-pyrrolidin-1-yl-butoxymethyl)-cyclohexylmethyl]-4-trifluoromethyl-benzenesulfonamide
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Basic information
- Standard SMILES
CN(CC1CCC(COCCCCN2CCCC2)CC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1- InChIKey
MCKAHGQUMRQPLX-UHFFFAOYSA-N- Molecular formula
- C24H37F3N2O3S
- Average molar mass
- 490.6 g/mol
- Monoisotopic mass
- 490.24769871
Names & identifiers
- Preferred name
- trans-N-methyl-N-[4-(4-pyrrolidin-1-yl-butoxymethyl)-cyclohexylmethyl]-4-trifluoromethyl-benzenesulfonamide
- IUPAC
- N-methyl-N-[[4-(4-pyrrolidin-1-ylbutoxymethyl)cyclohexyl]methyl]-4-(trifluoromethyl)benzenesulfonamide
Names & synonyms
trans-N-methyl-N-[4-(4-pyrrolidin-1-yl-butoxymethyl)-cyclohexylmethyl]-4-trifluoromethyl-benzenesulfonamideSCHEMBL6019114SCHEMBL6019119MCKAHGQUMRQPLX-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 22294151
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 661
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Related reactions
1 records
Compound notes
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