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3-(2,5-dimethylphenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one

3-(2,5-dimethylphenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one structure

CAS No:
380436-86-2
Formula:
C18H18N2OS2
Chemical Name:
3-(2,5-dimethylphenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Synonyms:
380436-86-2;4-(2,5-Dimethylphenyl)-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),5-trien-3-one;ZINC6016949;AKOS005198784;MCULE-3420086458;NE28131;3-(2,5-dimethylphenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one;EN300-03393;4-(2,5-dimethylphenyl)-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0?,?]trideca-1(9),2(7),5-trien-3-one

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3-(2,5-dimethylphenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one Basic Attributes

Molecular Weight：

342.5 g/mol

Exact Mass：

342.08605555 g/mol

Characteristics

PSA：

92.7 Å²

Computed Properties

Molecular Weight:342.5
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:342.08605555
Monoisotopic Mass:342.08605555
Topological Polar Surface Area:92.7
Heavy Atom Count:23
Complexity:511
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(2,5-dimethylphenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Basic Attributes
Characteristics
Computed Properties

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