4-((2,2-Dimethylcyclopentyl)amino)-n-((4'-fluoro(1,1'-biphenyl)-4-yl)carbonyl)-3-nitrobenzenesulfonamide
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Basic information
- Standard SMILES
CC1(C)CCCC1Nc1ccc(S(=O)(=O)NC(=O)c2ccc(-c3ccc(F)cc3)cc2)cc1[N+](=O)[O-]- InChIKey
FHGSVPNKBSWLHN-UHFFFAOYSA-N- Molecular formula
- C26H26FN3O5S
- Average molar mass
- 511.6 g/mol
- Monoisotopic mass
- 511.15772027
Names & identifiers
- Preferred name
- 4-((2,2-Dimethylcyclopentyl)amino)-n-((4'-fluoro(1,1'-biphenyl)-4-yl)carbonyl)-3-nitrobenzenesulfonamide
- IUPAC
- N-[4-[(2,2-dimethylcyclopentyl)amino]-3-nitrophenyl]sulfonyl-4-(4-fluorophenyl)benzamide
Names & synonyms
SCHEMBL2950193FHGSVPNKBSWLHN-UHFFFAOYSA-N4-((2,2-dimethylcyclopentyl)amino)-N-((4'-fluoro(1,1'-biphenyl)-4-yl)carbonyl)-3- nitrobenzenesulfonamide4-((2,2-dimethylcyclopentyl)amino)-n-((4'-fluoro(1,1'-biphenyl)-4-yl)carbonyl)-3-nitrobenzenesulfonamide
Database identifiers
- PubChem CID
- 9914331
Properties
Computed structural propertiesFilling in
- XLogP
- 6.5
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 886
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Related reactions
2 records
Compound notes
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