Norketotifen
2-piperidin-4-ylidene-6-thiatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-8-one
Molecular Identity
Norketotifen
2-piperidin-4-ylidene-6-thiatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-8-one
PubChem CID: 9904236
Nor-ketotifen is an organosulfur heterocyclic compound.
2D Structure
Properties
C18H17NOS
Molecular Formula
295.40
Molecular Weight
g/mol
295.1031
Exact Mass
Da
2.8
XLogP
Drug-like (Lipinski: < 5)
57.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
450
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Norketotifen34580-20-6N-DesmethylketotifenZ24BD2IFB310H-Benzo(4,5)cyclohepta(1,2-b)thiophen-10-one, 4,9-dihydro-4-(4-piperidinylidene)-4,9-Dihydro-4-(4-piperidinylidene)-10H-benzo(4,5)cyclohepta(1,2-b)thiophen-10-oneRefChem:166628Nor-ketotifen2-piperidin-4-ylidene-6-thiatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-8-one4-(piperidin-4-ylidene)-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-10(9H)-one4-(PIPERIDIN-4-YLIDENE)-4,9-DIHYDRO-10H-BENZO[4,5]CYCLOHEPTA[1,2-B]THIOPHEN-10-ONE2-(PIPERIDIN-4-YLIDENE)-6-THIATRICYCLO[8.4.0.0(3),?]TETRADECA-1(14),3(7),4,10,12-PENTAEN-8-ONEKetotifen Impurity 19UNII-Z24BD2IFB3Oprea1_655550
Data from PubChem (NCBI)
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