Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCN(c2cccc3c2ccn3S(=O)(=O)c2ccccc2)CC1- InChIKey
NIOSUPXBTKYHLM-UHFFFAOYSA-N- Molecular formula
- C23H27N3O4S
- Average molar mass
- 441.5 g/mol
Names & identifiers
- Preferred name
- t-butyl 4-(1-benzenesulfonyl-1H-indol-4-yl)piperazine-1-carboxylate
- IUPAC
- tert-butyl 4-[1-(benzenesulfonyl)indol-4-yl]piperazine-1-carboxylate
Names & synonyms
SCHEMBL1537845NIOSUPXBTKYHLM-UHFFFAOYSA-Nt-butyl 4-(l-benzenesulfonyl-1H-indol-4-yl)piperazine-1-carboxylatet-butyl 4-(1-benzenesulfonyl-1H-indol-4-yl)piperazine-1-carboxylatetert-butyl 4-[1-(phenylsulfonyl)-1h-indol-4-yl]-1-piperazinecarboxylate4-(1-Benzenesulfonyl-1H-indol-4-yl)-piperazine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 22015366
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 80.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 731
Related reactions
10 records
Linked notes
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