 Home > Encyclopedia > 5-ethylsulfanyl-11-methyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

5-ethylsulfanyl-11-methyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

5-ethylsulfanyl-11-methyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure

CAS No:
373371-35-8
Formula:
C19H21N3OS2
Chemical Name:
5-ethylsulfanyl-11-methyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
Oprea1_498764;MLS001173652;CHEMBL1700883;HMS2871P14;STK525609;ZINC20842185;AKOS002838234;MCULE-2886716774;SMR000538735;2-(ethylsulfanyl)-7-methyl-3-(4-methylphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;373371-35-8

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5-ethylsulfanyl-11-methyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes

Molecular Weight：

371.5 g/mol

Exact Mass：

371.11260465 g/mol

Characteristics

PSA：

89.4 Å²

Water Solubility：

35.6 [ug/mL]

Computed Properties

Molecular Weight:371.5
XLogP3:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:371.11260465
Monoisotopic Mass:371.11260465
Topological Polar Surface Area:89.4
Heavy Atom Count:25
Complexity:547
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-ethylsulfanyl-11-methyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

Basic Attributes
Characteristics
Computed Properties

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