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2-[1-(3,4-Dichlorobenzyl)-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile

2-[1-(3,4-Dichlorobenzyl)-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile structure

CAS No:
1144853-65-5
Formula:
C22H14Cl2N4O4S2
Chemical Name:
2-[1-(3,4-Dichlorobenzyl)-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile
Synonyms:
2-[1-(3,4-Dichlorobenzyl)-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile;CHEMBL490851;BDBM29580;CTK4A8757;DTXSID50655221;ZINC49878620;FT-0666552;isatin Michael acceptor (IMA) analogue, 13c;{1-[(3,4-Dichlorophenyl)methyl]-2-oxo-5-(thiomorpholine-4-sulfonyl)-1,2-dihydro-3H-indol-3-ylidene}propanedinitrile

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2-[1-(3,4-Dichlorobenzyl)-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile Basic Attributes

Molecular Weight：

533.40696

Exact Mass：

518.004

DSSTox ID：

DTXSID50655221

Characteristics

PSA：

139

XLogP3：

3.2

Density：

1.565±0.06 g/cm3(Predicted)

Melting Point：

262.2-263.1 °C

Boiling Point：

699.3±65.0 °C(Predicted)

2-[1-(3,4-Dichlorobenzyl)-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile Use and Manufacturing

Isatin sulfonamide analog

Computed Properties

Molecular Weight:519.4
XLogP3:3.2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:518.0040881
Monoisotopic Mass:518.0040881
Topological Polar Surface Area:139
Heavy Atom Count:33
Complexity:1000
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[1-(3,4-Dichlorobenzyl)-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

2-[1-(3,4-Dichlorobenzyl)-2-oxo-5-(thiomorpholinosulfonyl)indolin-3-ylidene]malononitrile

SDS

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