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

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

CAS No:
337340-74-6
Formula:
C15H11F3N4OS
Chemical Name:
2-(1,3-benzothiazol-2-yl)-4-(prop-2-enyliminomethyl)-5-(trifluoromethyl)-1H-pyrazol-3-one
Synonyms:
ZINC2820655;STK560698;STL023608;STL446376;AKOS000622273;AKOS005221420;AKOS005486458;ZINC100405517;ZINC100408673;MCULE-8031023805;(4Z)-2-(1,3-benzothiazol-2-yl)-4-[(prop-2-en-1-ylamino)methylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one;1-(1,3-benzothiazol-2-yl)-4-[(E)-(prop-2-en-1-ylimino)methyl]-3-(trifluoromethyl)-1H-pyrazol-5-ol;2-(1,3-benzothiazol-2-yl)-4-[(E)-(prop-2-en-1-ylimino)methyl]-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one;337340-74-6

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

Molecular Weight：

352.3 g/mol

Exact Mass：

352.06056665 g/mol

Characteristics

PSA：

85.8 Å²

Computed Properties

Molecular Weight:352.3
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:352.06056665
Monoisotopic Mass:352.06056665
Topological Polar Surface Area:85.8
Heavy Atom Count:24
Complexity:590
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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