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1-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,2,4-trimethyl-4-(3-methylphenyl)-1,2,3,4-tetrahydroquinoline

1-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,2,4-trimethyl-4-(3-methylphenyl)-1,2,3,4-tetrahydroquinoline structure

CAS No:
309276-14-0
Formula:
C28H28N2OS2
Chemical Name:
1-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,2,4-trimethyl-4-(3-methylphenyl)-1,2,3,4-tetrahydroquinoline
Synonyms:
1-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,2,4-trimethyl-4-(3-methylphenyl)-1,2,3,4-tetrahydroquinoline;Oprea1_148381;STK395165;AKOS000620175;AKOS022016002;MCULE-8993655257;AG-205/12756065;SR-01000526515;SR-01000526515-1;2-(1,3-benzothiazol-2-ylsulfanyl)-1-[2,2,4-trimethyl-4-(3-methylphenyl)-3,4-dihydro-1(2H)-quinolinyl]-1-ethanone

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1-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,2,4-trimethyl-4-(3-methylphenyl)-1,2,3,4-tetrahydroquinoline Basic Attributes

Molecular Weight：

472.66472

Exact Mass：

472.164

Characteristics

PSA：

86.7

XLogP3：

7.7

Density：

1.27±0.1 g/cm3(Predicted)

Computed Properties

Molecular Weight:472.7
XLogP3:7.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:472.16430587
Monoisotopic Mass:472.16430587
Topological Polar Surface Area:86.7
Heavy Atom Count:33
Complexity:714
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,2,4-trimethyl-4-(3-methylphenyl)-1,2,3,4-tetrahydroquinoline

Basic Attributes
Characteristics
Computed Properties

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