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

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

CAS No:
727677-23-8
Formula:
C15H17ClN4OS
Chemical Name:
1-(2-chlorophenyl)-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one
Synonyms:
1-(2-chlorophenyl)-6-propyl-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one;MLS000729356;CHEMBL1352875;HMS2710F14;STK586570;STK792201;ZINC19874211;AKOS001756280;AKOS005509667;MCULE-3835075627;SMR000307634;1-(2-chlorophenyl)-6-propyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one;727677-23-8

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

Molecular Weight：

336.8 g/mol

Exact Mass：

336.0811600 g/mol

Characteristics

PSA：

79.7 Å²

Water Solubility：

>50.5 [ug/mL]

Computed Properties

Molecular Weight:336.8
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:336.0811600
Monoisotopic Mass:336.0811600
Topological Polar Surface Area:79.7
Heavy Atom Count:22
Complexity:510
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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