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2,6-diamino-4-(4-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile

2,6-diamino-4-(4-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile structure

CAS No:
127118-57-4
Formula:
C13H9N5O2S
Chemical Name:
2,6-diamino-4-(4-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile
Synonyms:
2,6-diamino-4-(4-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile;127118-57-4;2,6-Diamino-4-(4-nitro-phenyl)-4H-thiopyran-3,5-dicarbonitrile;Cambridge id 5212008;Oprea1_353489;MLS000567488;CHEMBL1428292;BFNUGJIXTMHBIE-UHFFFAOYSA-;HMS2545E10;ZINC2314791;RSC006931;STK725723;AKOS000579529;MCULE-7508045920;SMR000176301;ST4002956;418A609;SR-01000508050;SR-01000508050-1;Z57075124;F0291-0299;2,6-diamino-4-(4-nitrophenyl)-4H-thiin-3,5-dicarbonitrile

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2,6-diamino-4-(4-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile Basic Attributes

Molecular Weight：

299.31 g/mol

Exact Mass：

299.04769572 g/mol

Characteristics

PSA：

171 Å²

Computed Properties

Molecular Weight:299.31
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:299.04769572
Monoisotopic Mass:299.04769572
Topological Polar Surface Area:171
Heavy Atom Count:21
Complexity:584
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,6-diamino-4-(4-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile

Basic Attributes
Characteristics
Computed Properties

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