 Home > Encyclopedia > 3-benzyl-8,8-dimethyl-2-thioxo-1,2,3,6,8,9-hexahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one

3-benzyl-8,8-dimethyl-2-thioxo-1,2,3,6,8,9-hexahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one

3-benzyl-8,8-dimethyl-2-thioxo-1,2,3,6,8,9-hexahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one structure

CAS No:
303051-70-9
Formula:
C19H19N3O2S
Chemical Name:
3-benzyl-8,8-dimethyl-2-thioxo-1,2,3,6,8,9-hexahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Synonyms:
3-benzyl-8,8-dimethyl-2-thioxo-1,2,3,6,8,9-hexahydro-4H-pyrano[3",4":5,6]pyrido[2,3-d]pyrimidin-4-one;ChemDiv1_021767;Oprea1_073347;Oprea1_539843;HMS648N09;ZINC8739705;STK042809;AKOS005383412;MCULE-4895513876;AG-690/09375046

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3-benzyl-8,8-dimethyl-2-thioxo-1,2,3,6,8,9-hexahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one Basic Attributes

Molecular Weight：

353.43806

Exact Mass：

353.12

Characteristics

PSA：

86.6

XLogP3：

2.3

Melting Point：

310 - 312 °C (butan-1-ol)

Computed Properties

Molecular Weight:353.4
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:353.11979803
Monoisotopic Mass:353.11979803
Topological Polar Surface Area:86.6
Heavy Atom Count:25
Complexity:547
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-benzyl-8,8-dimethyl-2-thioxo-1,2,3,6,8,9-hexahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one

Basic Attributes
Characteristics
Computed Properties

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