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

HCID 214827

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Basic information

CAS: 34334-43-5
Standard SMILES: CC12CCC(CN(C(=O)NS(=O)(=O)c3ccc(Cl)cc3)C1)C2(C)C
InChIKey: STHHABLIHXTCAK-UHFFFAOYSA-N
Molecular formula: C17H23ClN2O3S
Average molar mass: 370.9 g/mol
Monoisotopic mass: 370.1117915

Names & identifiers

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

Names & synonyms

71-17 R&CN-((4-Chlorophenyl)sulfonyl)-1,8,8-trimethyl-3-azabicyclo(3.2.1)octane-3-carboxamide34334-43-5(Chloro-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-chlorophenyl)sulfonyl)-1,8,8-trimethyl-(Chloro-4 benzene sulfonylamino-carbonyl)-3 trimethyl-1,8,8 3-azabicyclo(3,2,1)octaneRefChem:276761DTXSID40955888N-(4-Chlorobenzene-1-sulfonyl)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-3-carboximidic acid

Database identifiers

CAS: 34334-43-5
PubChem CID: 214827
DTXSID: DTXSID40955888

Properties

Computed structural properties

XLogP: 3.7
Topological polar surface area: 74.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 24
Formal charge: 0
Complexity: 608

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