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

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

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

CAS No:
782459-50-1
Formula:
C25H25N5O3S
Chemical Name:
1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[4-(4-ethoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Synonyms:
ZINC2627025;AKOS033453918;MCULE-6948560421;Z15949147;1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-{[4-(4-ethoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one;782459-50-1

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

Molecular Weight：

475.6 g/mol

Exact Mass：

475.16781085 g/mol

Characteristics

PSA：

128 Å²

Computed Properties

Molecular Weight:475.6
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:475.16781085
Monoisotopic Mass:475.16781085
Topological Polar Surface Area:128
Heavy Atom Count:34
Complexity:704
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: soda ash na2co3; formula aluminium hydroxide; cro3; capric acid; ammonium formula; remeron generic name

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

Basic Attributes
Characteristics
Computed Properties

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