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2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone

2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone structure

CAS No:
757194-77-7
Formula:
C21H19N3O3S
Chemical Name:
2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone
Synonyms:
ZINC2661752;AKOS017022047;MCULE-9988361312;Z24160268;2-[(5-cyclopropyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-one;757194-77-7

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2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Basic Attributes

Molecular Weight：

393.5 g/mol

Exact Mass：

393.11471265 g/mol

Characteristics

PSA：

91.5 Å²

Computed Properties

Molecular Weight:393.5
XLogP3:3.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:393.11471265
Monoisotopic Mass:393.11471265
Topological Polar Surface Area:91.5
Heavy Atom Count:28
Complexity:555
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone

Basic Attributes
Characteristics
Computed Properties

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