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1-(2-phenylethyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one

1-(2-phenylethyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one structure

CAS No:
727677-22-7
Formula:
C17H22N4OS
Chemical Name:
1-(2-phenylethyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one
Synonyms:
1-(2-phenylethyl)-6-propyl-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one;MLS000729355;CHEMBL1095796;HMS2710D18;STK596835;STK780617;ZINC17028803;AKOS001756279;AKOS005518390;MCULE-9819181020;SMR000307633;MLS000729355-02;1-phenethyl-6-propyl-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one;1-(2-phenylethyl)-6-propyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one;727677-22-7

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1-(2-phenylethyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Basic Attributes

Molecular Weight：

330.4 g/mol

Exact Mass：

330.15143251 g/mol

Characteristics

PSA：

79.7 Å²

Water Solubility：

1.7 [ug/mL]

Computed Properties

Molecular Weight:330.4
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:330.15143251
Monoisotopic Mass:330.15143251
Topological Polar Surface Area:79.7
Heavy Atom Count:23
Complexity:499
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2-phenylethyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one

Basic Attributes
Characteristics
Computed Properties

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