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3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-5H-pyrimido[5,4-b]indol-4-one

3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-5H-pyrimido[5,4-b]indol-4-one structure

CAS No:
537668-39-6
Formula:
C19H14F3N3OS
Chemical Name:
3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-5H-pyrimido[5,4-b]indol-4-one
Synonyms:
537668-39-6;3-methyl-2-((4-(trifluoromethyl)benzyl)thio)-3H-pyrimido[5,4-b]indol-4(5H)-one;3-methyl-2-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H,4H,5H-pyrimido[5,4-b]indol-4-one;CHEMBL1712469;HMS1901M14;ZINC2720599;AKOS002054336;MCULE-2490421574;3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-5H-pyrimido[5,4-b]indol-4-one;NCGC00135606-01;G856-0792;F0580-0074;3-methyl-2-{[4-(trifluoromethyl)benzyl]thio}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

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3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-5H-pyrimido[5,4-b]indol-4-one Basic Attributes

Molecular Weight：

389.4 g/mol

Exact Mass：

389.08096774 g/mol

Characteristics

PSA：

73.8 Å²

Computed Properties

Molecular Weight:389.4
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:389.08096774
Monoisotopic Mass:389.08096774
Topological Polar Surface Area:73.8
Heavy Atom Count:27
Complexity:604
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-5H-pyrimido[5,4-b]indol-4-one

Basic Attributes
Characteristics
Computed Properties

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