ethyl 2-[[3-(4-nitrophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate
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ethyl 2-[[3-(4-nitrophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate
structure -
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CAS No:
536717-39-2
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Formula:
C20H16N4O5S
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Chemical Name:
ethyl 2-[[3-(4-nitrophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate
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Synonyms:
536717-39-2;ethyl 2-((3-(4-nitrophenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetate;ethyl 2-{[3-(4-nitrophenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetate;Oprea1_668914;ZINC2720982;AKOS002052803;MCULE-9144292925;ethyl 2-[[3-(4-nitrophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate;EU-0089055;F0580-1111;ethyl {[3-(4-nitrophenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]thio}acetate
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CAS No:
ethyl 2-[[3-(4-nitrophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate Basic Attributes
424.4 g/mol
424.08414080 g/mol
Computed Properties
Molecular Weight:424.4
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:424.08414080
Monoisotopic Mass:424.08414080
Topological Polar Surface Area:146
Heavy Atom Count:30
Complexity:719
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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