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2-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

2-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile structure

CAS No:
311773-25-8
Formula:
C20H20N2O5
Chemical Name:
2-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Synonyms:
2-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile;Oprea1_648783;SCHEMBL6707588;CHEMBL1437786;HMS2796B04;RSC001627;STK853657;AKOS002928214;MCULE-2044987980;ST070422

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2-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile Basic Attributes

Molecular Weight：

368.3832

Exact Mass：

368.137

Characteristics

PSA：

104

XLogP3：

2.6

Melting Point：

239 - 243 °C

Water Solubility：

21.6 [ug/mL]

Computed Properties

Molecular Weight:368.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:368.13722174
Monoisotopic Mass:368.13722174
Topological Polar Surface Area:104
Heavy Atom Count:27
Complexity:775
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 2-bromo-2-methylbutane; sds for hydrochloric acid; isoamyl acetate; potassium sulfide formula; keratolysis exfoliativa; acetylene formula

Guide of 2-amino-4-(7-methoxy-1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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