 Home > Encyclopedia > 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-benzyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-benzyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-benzyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone structure

CAS No:
782461-54-5
Formula:
C27H28N4O3S
Chemical Name:
1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-benzyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone
Synonyms:
ZINC2627626;AKOS000861592;MCULE-7855878372;Z18675686;1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-{[5-benzyl-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;782461-54-5

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1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-benzyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Basic Attributes

Molecular Weight：

488.6 g/mol

Exact Mass：

488.18821194 g/mol

Characteristics

PSA：

115 Å²

Computed Properties

Molecular Weight:488.6
XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:488.18821194
Monoisotopic Mass:488.18821194
Topological Polar Surface Area:115
Heavy Atom Count:35
Complexity:711
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: malonic acid; copper i oxide; hclo2; acetanilide melting point; vanadium nitride; calcium carbonate formula

Guide of 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[5-benzyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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