 Home > Encyclopedia > 2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone structure

CAS No:
871484-94-5
Formula:
C21H26N4O2S
Chemical Name:
2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone
Synonyms:
ZINC2638864;AKOS033428603;MCULE-5058047795;Z15606816;2-{[5-(4-methoxyphenyl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1,2,5-trimethyl-1H-pyrrol-3-yl)ethan-1-one;871484-94-5

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2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Basic Attributes

Molecular Weight：

398.5 g/mol

Exact Mass：

398.17764726 g/mol

Characteristics

PSA：

87.2 Å²

Computed Properties

Molecular Weight:398.5
XLogP3:3.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:398.17764726
Monoisotopic Mass:398.17764726
Topological Polar Surface Area:87.2
Heavy Atom Count:28
Complexity:527
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Basic Attributes
Characteristics
Computed Properties

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