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4-[2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]benzonitrile

4-[2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]benzonitrile structure

CAS No:
721411-90-1
Formula:
C26H21N3O2S2
Chemical Name:
4-[2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]benzonitrile
Synonyms:
ZINC3224336;AKOS034461959;MCULE-7568912113;Z56861410;4-(2-{[4-(4-methylphenyl)-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl]sulfanyl}acetyl)benzonitrile;721411-90-1

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4-[2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]benzonitrile Basic Attributes

Molecular Weight：

471.6 g/mol

Exact Mass：

471.10751927 g/mol

Characteristics

PSA：

127 Å²

Computed Properties

Molecular Weight:471.6
XLogP3:6.1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:471.10751927
Monoisotopic Mass:471.10751927
Topological Polar Surface Area:127
Heavy Atom Count:33
Complexity:836
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: phosphorus trichloride formula; dipotassium oxide; aluminum nitrate; acetate formula; sulfur trioxide; boric acud

Guide of 4-[2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetyl]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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