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ethyl 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate

ethyl 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate structure

CAS No:
536710-45-9
Formula:
C22H21N3O4S
Chemical Name:
ethyl 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate
Synonyms:
536710-45-9;ethyl {[3-(4-ethoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]thio}acetate;ethyl 2-{[3-(4-ethoxyphenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetate;Oprea1_324029;CHEMBL1551206;HMS1901L21;ZINC2720835;AKOS001578767;MCULE-3575520488;ethyl 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate;NCGC00135730-01;SR-01000907049;SR-01000907049-1;G856-1121;F0580-0641;ethyl 2-((3-(4-ethoxyphenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetate

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ethyl 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate Basic Attributes

Molecular Weight：

423.5 g/mol

Exact Mass：

423.12527733 g/mol

Characteristics

PSA：

109 Å²

Computed Properties

Molecular Weight:423.5
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:423.12527733
Monoisotopic Mass:423.12527733
Topological Polar Surface Area:109
Heavy Atom Count:30
Complexity:665
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetate

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

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