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methyl 2-[6-amino-3,5-dicyano-4-(4-hydroxyphenyl)pyridin-2-yl]sulfanylacetate

methyl 2-[6-amino-3,5-dicyano-4-(4-hydroxyphenyl)pyridin-2-yl]sulfanylacetate structure

CAS No:
5212-06-6
Formula:
C16H12N4O3S
Chemical Name:
methyl 2-[6-amino-3,5-dicyano-4-(4-hydroxyphenyl)pyridin-2-yl]sulfanylacetate
Synonyms:
CBMicro_013782;MLS000777564;SMR000413958;[6-Amino-3,5-dicyano-4-(4-hydroxy-phenyl)-pyridin-2-ylsulfanyl]-acetic acid methyl ester;5212-06-6;CHEMBL1413466;SCHEMBL13913521;BDBM97125;cid_5337862;DTXSID70416730;HMS2752F11;SMSF0004518;STL324004;ZINC20813967;AKOS022113686;CB08319;MCULE-4868364635;methyl 2-[[6-amino-3,5-dicyano-4-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridin-2-yl]sulfanyl]acetate;BIM-0014012.P001;methyl {[6-amino-3,5-dicyano-4-(4-hydroxyphenyl)pyridin-2-yl]sulfanyl}acetate;2-[[6-amino-3,5-dicyano-4-(4-ketocyclohexa-2,5-dien-1-ylidene)-1H-pyridin-2-yl]thio]acetic acid methyl ester;2-[[6-amino-3,5-dicyano-4-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyridin-2-yl]thio]acetic acid methyl ester;221178-99-0;methyl 2-[[6-azanyl-3,5-dicyano-4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyridin-2-yl]sulfanyl]ethanoate

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methyl 2-[6-amino-3,5-dicyano-4-(4-hydroxyphenyl)pyridin-2-yl]sulfanylacetate Basic Attributes

Molecular Weight：

340.4 g/mol

Exact Mass：

340.06301143 g/mol

DSSTox ID：

DTXSID70416730

Characteristics

PSA：

158 Å²

Water Solubility：

0.6 [ug/mL]

Computed Properties

Molecular Weight:340.4
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:340.06301143
Monoisotopic Mass:340.06301143
Topological Polar Surface Area:158
Heavy Atom Count:24
Complexity:546
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl 2-[6-amino-3,5-dicyano-4-(4-hydroxyphenyl)pyridin-2-yl]sulfanylacetate

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

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