3-(4-methylphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one
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![3-(4-methylphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9c86d2f542da4c5d984a03e0a87943a1.png "3-(4-methylphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one")
3-(4-methylphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one
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CAS No:
536705-16-5
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Formula:
C25H19N3O2S
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Chemical Name:
3-(4-methylphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one
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Synonyms:
536705-16-5;2-((2-oxo-2-phenylethyl)thio)-3-(p-tolyl)-3H-pyrimido[5,4-b]indol-4(5H)-one;3-(4-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-one;Oprea1_141620;CHEMBL1595959;HMS1901H03;ZINC2720689;3-(4-methylphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one;AKOS002054241;MCULE-7668288949;NCGC00135441-01;G856-0921;F0580-0269;3-(4-methylphenyl)-2-[(2-oxo-2-phenylethyl)thio]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
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CAS No:
3-(4-methylphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Basic Attributes
425.5 g/mol
425.11979803 g/mol
Computed Properties
Molecular Weight:425.5
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:425.11979803
Monoisotopic Mass:425.11979803
Topological Polar Surface Area:90.8
Heavy Atom Count:31
Complexity:712
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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