 Home > Encyclopedia > 4-Bromo-N-[[4-methyl-5-(2-propyn-1-ylthio)-4H-1,2,4-triazol-3-yl]methyl]benzenesulfonamide

4-Bromo-N-[[4-methyl-5-(2-propyn-1-ylthio)-4H-1,2,4-triazol-3-yl]methyl]benzenesulfonamide

4-Bromo-N-[[4-methyl-5-(2-propyn-1-ylthio)-4H-1,2,4-triazol-3-yl]methyl]benzenesulfonamide structure

CAS No:
338421-59-3
Formula:
C13H13BrN4O2S2
Chemical Name:
4-Bromo-N-[[4-methyl-5-(2-propyn-1-ylthio)-4H-1,2,4-triazol-3-yl]methyl]benzenesulfonamide
Synonyms:
Benzenesulfonamide,4-bromo-N-[[4-methyl-5-(2-propyn-1-ylthio)-4H-1,2,4-triazol-3-yl]methyl]-;Benzenesulfonamide,4-bromo-N-[[4-methyl-5-(2-propynylthio)-4H-1,2,4-triazol-3-yl]methyl]-;4-Bromo-N-[[4-methyl-5-(2-propyn-1-ylthio)-4H-1,2,4-triazol-3-yl]methyl]benzenesulfonamide

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4-Bromo-N-[[4-methyl-5-(2-propyn-1-ylthio)-4H-1,2,4-triazol-3-yl]methyl]benzenesulfonamide Basic Attributes

Molecular Weight：

401.3

Exact Mass：

401.30

Characteristics

PSA：

111

XLogP3：

1.6

Density：

1.57±0.1 g/cm3(Predicted)

Computed Properties

Molecular Weight:401.3
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:399.96633
Monoisotopic Mass:399.96633
Topological Polar Surface Area:111
Heavy Atom Count:22
Complexity:508
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Bromo-N-[[4-methyl-5-(2-propyn-1-ylthio)-4H-1,2,4-triazol-3-yl]methyl]benzenesulfonamide

Basic Attributes
Characteristics
Computed Properties

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