(4as,8ar)-N-Cyclohexyl-4a,5,6,7,8,8a-Hexahydro-4,1,2-Benzoxathiazin-3-Amine 1,1-Dioxide
(4aS,8aR)-N-cyclohexyl-1,1-dioxo-4a,5,6,7,8,8a-hexahydrobenzo[e][1,4,3]oxathiazin-3-imine
Molecular Identity
(4as,8ar)-N-Cyclohexyl-4a,5,6,7,8,8a-Hexahydro-4,1,2-Benzoxathiazin-3-Amine 1,1-Dioxide
(4aS,8aR)-N-cyclohexyl-1,1-dioxo-4a,5,6,7,8,8a-hexahydrobenzo[e][1,4,3]oxathiazin-3-imine
PubChem CID: 135566823
2D Structure
Properties
C13H22N2O3S
Molecular Formula
286.39
Molecular Weight
g/mol
286.1351
Exact Mass
Da
2.5
XLogP
Drug-like (Lipinski: < 5)
76.1
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
4
H-Bond Acceptors
449
Complexity
SMILES
Canonical SMILES
SMILES: C1CCC(CC1)N=C2NS(=O)(=O)C3CCCCC3O2Isomeric SMILES
SMILES: C1CCC(CC1)N=C2NS(=O)(=O)[C@@H]3CCCC[C@@H]3O2Synonyms(6)
CHEMBL2409730(4as,8ar)-N-Cyclohexyl-4a,5,6,7,8,8a-Hexahydro-4,1,2-Benzoxathiazin-3-Amine 1,1-DioxideSFFSCHEMBL16270541BDBM50438064Q27465335
Data from PubChem (NCBI)
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Molecular Structure
(4as,8ar)-N-Cyclohexyl-4a,5,6,7,8,8a-Hexahydro-4,1,2-Benzoxathiazin-3-Amine 1,1-Dioxide
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Drug Network
Trials and conditions connected to (4as,8ar)-N-Cyclohexyl-4a,5,6,7,8,8a-Hexahydro-4,1,2-Benzoxathiazin-3-Amine 1,1-Dioxide
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