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2-amino-6-(hydroxymethyl)-4-(3-methoxyphenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile

2-amino-6-(hydroxymethyl)-4-(3-methoxyphenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile structure

CAS No:
664999-61-5
Formula:
C17H14N2O5
Chemical Name:
2-amino-6-(hydroxymethyl)-4-(3-methoxyphenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Synonyms:
2-amino-6-(hydroxymethyl)-4-(3-methoxyphenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile;2-amino-6-(hydroxymethyl)-4-(3-methoxyphenyl)-8-oxo-4H,8H-pyrano[3,2-b]pyran-3-carbonitrile;ZINC00377549;CHEMBL1538323;KS-00003RPM;RSCBB000632;HMS2170N17;HMS3319L17;CCG-25490;RSC000957

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2-amino-6-(hydroxymethyl)-4-(3-methoxyphenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile Basic Attributes

Molecular Weight：

326.30346

Exact Mass：

326.09

Characteristics

PSA：

115

XLogP3：

0.8

Melting Point：

210 - 212 °C

Computed Properties

Molecular Weight:326.30
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:326.09027155
Monoisotopic Mass:326.09027155
Topological Polar Surface Area:115
Heavy Atom Count:24
Complexity:697
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-amino-6-(hydroxymethyl)-4-(3-methoxyphenyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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