Tecovirimat
N-[(1R,2R,6S,7S,8S,10R)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-4-(trifluoromethyl)benzamide
Molecular Identity
Tecovirimat
N-[(1R,2R,6S,7S,8S,10R)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-4-(trifluoromethyl)benzamide
PubChem CID: 16124688
2D Structure
Properties
C19H15F3N2O3
Molecular Formula
376.30
Molecular Weight
g/mol
376.1035
Exact Mass
Da
2.6
XLogP
Drug-like (Lipinski: < 5)
66.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
705
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Tecovirimat869572-92-9ST-246SIGA-246ST 246F925RR824RDTXSID101026474N-((3aR,4R,4aR,5aS,6S,6aS)-1,3-Dioxo-3,3a,4,4a,5,5a,6,6a-octahydro-4,6-ethenocyclopropa(f)isoindol-2(1H)-yl)-4-(trifluoromethyl)benzamide4-trifluoromethyl-N-(3,3a,4,4a,5,5a,6,6a-octahydro-1,3-dioxo-4,6-ethenocycloprop(f)isoindol-2(1H)-yl)-benzamidetecovirimatumN-[(3aR,4R,4aR,5aS,6S,6aS)-1,3-dioxo-3,3a,4,4a,5,5a,6,6a-octahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl]-4-(trifluoromethyl)benzamideRefChem:58026J05AX24DTXCID301510657N-((1R,2R,6S,7S,8S,10R)-3,5-dioxo-4-azatetracyclo(5.3.2.0^(2,6).0^(8,10))dodec-11-en-4-yl)-4-(trifluoromethyl)benzamide
Data from PubChem (NCBI)
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