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3-(4-ethoxyphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one

3-(4-ethoxyphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one structure

CAS No:
536710-49-3
Formula:
C26H21N3O3S
Chemical Name:
3-(4-ethoxyphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one
Synonyms:
536710-49-3;3-(4-ethoxyphenyl)-2-((2-oxo-2-phenylethyl)thio)-3H-pyrimido[5,4-b]indol-4(5H)-one;3-(4-ethoxyphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H,4H,5H-pyrimido[5,4-b]indol-4-one;Oprea1_774658;CHEMBL1483980;HMS1901P21;ZINC2720840;3-(4-ethoxyphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one;AKOS002053434;MCULE-3133817457;NCGC00135734-01;EU-0022318;G856-1124;F0580-0645;3-(4-ethoxyphenyl)-2-[(2-oxo-2-phenylethyl)thio]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

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3-(4-ethoxyphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Basic Attributes

Molecular Weight：

455.5 g/mol

Exact Mass：

455.13036271 g/mol

Characteristics

PSA：

100 Å²

Computed Properties

Molecular Weight:455.5
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:455.13036271
Monoisotopic Mass:455.13036271
Topological Polar Surface Area:100
Heavy Atom Count:33
Complexity:745
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(4-ethoxyphenyl)-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one

Basic Attributes
Characteristics
Computed Properties

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