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2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone

2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone structure

CAS No:
851629-90-8
Formula:
C24H26N6OS
Chemical Name:
2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone
Synonyms:
ZINC3364055;AKOS033693022;MCULE-8344326201;SR-01000064051;SR-01000064051-1;Z19584913;2-{[5-(1H-indol-3-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylpiperazin-1-yl)ethan-1-one;851629-90-8

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2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone Basic Attributes

Molecular Weight：

446.6 g/mol

Exact Mass：

446.18888065 g/mol

Characteristics

PSA：

95.4 Å²

Computed Properties

Molecular Weight:446.6
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:446.18888065
Monoisotopic Mass:446.18888065
Topological Polar Surface Area:95.4
Heavy Atom Count:32
Complexity:644
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[5-(1H-indol-3-yl)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone

Basic Attributes
Characteristics
Computed Properties

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