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3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one structure

CAS No:
65234-03-9
Formula:
C18H18N2O2S2
Chemical Name:
3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Synonyms:
[1]Benzothieno[2,3-d]pyrimidin-4(1H)-one,3-(4-ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo-;3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

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3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one Basic Attributes

Molecular Weight：

358.47800

Exact Mass：

358.48

DSSTox ID：

DTXSID20368255

HScode：

2934999090

Characteristics

PSA：

111.16000

XLogP3：

4.01340

Density：

1.41g/cm3

Melting Point：

288-290 °C @ Solvent: Acetic acid

Boiling Point：

566ºC at 760 mmHg

Flash Point：

296.1ºC

Refractive Index：

1.707

Computed Properties

Molecular Weight:358.5
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:358.08097017
Monoisotopic Mass:358.08097017
Topological Polar Surface Area:102
Heavy Atom Count:24
Complexity:507
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

Basic Attributes
Characteristics
Computed Properties

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