 Home > Encyclopedia > 5-(3-methylbutylsulfanyl)-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

5-(3-methylbutylsulfanyl)-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

5-(3-methylbutylsulfanyl)-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one structure

CAS No:
351160-02-6
Formula:
C22H26N2OS2
Chemical Name:
5-(3-methylbutylsulfanyl)-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Synonyms:
2-(isopentylsulfanyl)-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one;Oprea1_101818;ZINC2275415;STK831096;AKOS001645453;MCULE-6436889341;AJ-292/15342007;SR-01000460096;SR-01000460096-1;2-[(3-methylbutyl)sulfanyl]-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one;2-[(3-methylbutyl)thio]-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one;351160-02-6

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5-(3-methylbutylsulfanyl)-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one Basic Attributes

Molecular Weight：

398.6 g/mol

Exact Mass：

398.14865580 g/mol

Characteristics

PSA：

86.2 Å²

Computed Properties

Molecular Weight:398.6
XLogP3:6.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:398.14865580
Monoisotopic Mass:398.14865580
Topological Polar Surface Area:86.2
Heavy Atom Count:27
Complexity:559
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: sodium stearate; copper sulphide; phenylacetaldehyde; barium oxide; iodide formula; nitrogen trioxide

Guide of 5-(3-methylbutylsulfanyl)-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

Basic Attributes
Characteristics
Computed Properties

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