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3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-10,10-dioxothioxanthen-9-one

3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-10,10-dioxothioxanthen-9-one structure

CAS No:
306958-48-5
Formula:
C23H17NO4S
Chemical Name:
3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-10,10-dioxothioxanthen-9-one
Synonyms:
Oprea1_597362;ZINC3216725;AKOS034024908;CCG-349669;MCULE-5075426493;Z27717170;3-(1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-9H-10lambda6-thioxanthene-9,10,10-trione;306958-48-5

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3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-10,10-dioxothioxanthen-9-one Basic Attributes

Molecular Weight：

403.5 g/mol

Exact Mass：

403.08782920 g/mol

Characteristics

PSA：

79.9 Å²

Computed Properties

Molecular Weight:403.5
XLogP3:3.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:403.08782920
Monoisotopic Mass:403.08782920
Topological Polar Surface Area:79.9
Heavy Atom Count:29
Complexity:772
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-10,10-dioxothioxanthen-9-one

Basic Attributes
Characteristics
Computed Properties

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