3-Azabicyclo(3.2.1)octane-3-carboxamide, N-((4-aminophenyl)sulfonyl)-1,8,8-trimethyl-

HCID 214828

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Basic information

CAS: 34334-44-6
Standard SMILES: CC12CCC(CN(C(=O)NS(=O)(=O)c3ccc(N)cc3)C1)C2(C)C
InChIKey: MALOWAXITLNPQR-UHFFFAOYSA-N
Molecular formula: C17H25N3O3S
Average molar mass: 351.5 g/mol
Monoisotopic mass: 351.16166284

Names & identifiers

Preferred name: 3-Azabicyclo(3.2.1)octane-3-carboxamide, N-((4-aminophenyl)sulfonyl)-1,8,8-trimethyl-
IUPAC: N-(4-aminophenyl)sulfonyl-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-3-carboxamide

Names & synonyms

84-33 R&CN-((4-Aminophenyl)sulfonyl)-1,8,8-trimethyl-3-azabicyclo(3.2.1)octane-3-carboxamide34334-44-6(Amino-4 benzene sulfonylamino-carbonyl)-3 trimethyl-1,8,8 3-azabicyclo(3,2,1)octane [French]3-Azabicyclo(3.2.1)octane-3-carboxamide, N-((4-aminophenyl)sulfonyl)-1,8,8-trimethyl-(Amino-4 benzene sulfonylamino-carbonyl)-3 trimethyl-1,8,8 3-azabicyclo(3,2,1)octanen-[(4-aminophenyl)sulfonyl]-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-3-carboxamideRefChem:276759DTXSID00955889N-(4-Aminobenzene-1-sulfonyl)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-3-carboximidic acid

Database identifiers

CAS: 34334-44-6
PubChem CID: 214828
DTXSID: DTXSID00955889

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 101 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 24
Formal charge: 0
Complexity: 605

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