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2-(1,3-benzothiazol-2-yl)-4-(3-hydroxypropyliminomethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one

2-(1,3-benzothiazol-2-yl)-4-(3-hydroxypropyliminomethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one structure

CAS No:
371946-31-5
Formula:
C15H13F3N4O2S
Chemical Name:
2-(1,3-benzothiazol-2-yl)-4-(3-hydroxypropyliminomethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one
Synonyms:
ZINC4476852;STK741720;STL446108;AKOS005221411;AKOS005524219;ZINC103529360;ZINC104291662;MCULE-3252179154;(4Z)-2-(1,3-benzothiazol-2-yl)-4-{[(3-hydroxypropyl)amino]methylidene}-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one;2-(1,3-benzothiazol-2-yl)-4-{(E)-[(3-hydroxypropyl)imino]methyl}-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one;371946-31-5

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2-(1,3-benzothiazol-2-yl)-4-(3-hydroxypropyliminomethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one Basic Attributes

Molecular Weight：

370.4 g/mol

Exact Mass：

370.07113133 g/mol

Characteristics

PSA：

106 Å²

Computed Properties

Molecular Weight:370.4
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:370.07113133
Monoisotopic Mass:370.07113133
Topological Polar Surface Area:106
Heavy Atom Count:25
Complexity:582
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1,3-benzothiazol-2-yl)-4-(3-hydroxypropyliminomethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one

Basic Attributes
Characteristics
Computed Properties

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