 Home > Encyclopedia > 12-benzyl-16-(3-methylbutylsulfanyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one

12-benzyl-16-(3-methylbutylsulfanyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one

12-benzyl-16-(3-methylbutylsulfanyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one structure

CAS No:
372495-26-6
Formula:
C30H34N4OS
Chemical Name:
12-benzyl-16-(3-methylbutylsulfanyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one
Synonyms:
Oprea1_414098;ZINC2276781;STK525570;AKOS005459164;MCULE-6247305476;372495-26-6;4-benzyl-1-[(3-methylbutyl)sulfanyl]-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one

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12-benzyl-16-(3-methylbutylsulfanyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one Basic Attributes

Molecular Weight：

498.7 g/mol

Exact Mass：

498.24533289 g/mol

Characteristics

PSA：

76.3 Å²

Computed Properties

Molecular Weight:498.7
XLogP3:7.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:498.24533289
Monoisotopic Mass:498.24533289
Topological Polar Surface Area:76.3
Heavy Atom Count:36
Complexity:831
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 12-benzyl-16-(3-methylbutylsulfanyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one

Basic Attributes
Characteristics
Computed Properties

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