 Home > Encyclopedia > 2-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)ethanone

2-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)ethanone

2-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)ethanone structure

CAS No:
851396-18-4
Formula:
C25H25N5OS
Chemical Name:
2-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)ethanone
Synonyms:
ZINC3332882;AKOS033916070;MCULE-1225703552;Z24539007;2-{[4-benzyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1-cyclopropyl-2,5-dimethyl-1H-pyrrol-3-yl)ethan-1-one;851396-18-4

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2-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)ethanone Basic Attributes

Molecular Weight：

443.6 g/mol

Exact Mass：

443.17798161 g/mol

Characteristics

PSA：

90.9 Å²

Computed Properties

Molecular Weight:443.6
XLogP3:3.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:443.17798161
Monoisotopic Mass:443.17798161
Topological Polar Surface Area:90.9
Heavy Atom Count:32
Complexity:640
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)ethanone

Basic Attributes
Characteristics
Computed Properties

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