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ethyl 2-{[2,2,2-trifluoro-1-[(3-phenylpropanoyl)amino]-1-(trifluoromethyl)ethyl]amino}-1,3-benzothiazole-6-carboxylate

ethyl 2-{[2,2,2-trifluoro-1-[(3-phenylpropanoyl)amino]-1-(trifluoromethyl)ethyl]amino}-1,3-benzothiazole-6-carboxylate structure

CAS No:
488717-01-7
Formula:
C22H19F6N3O3S
Chemical Name:
ethyl 2-{[2,2,2-trifluoro-1-[(3-phenylpropanoyl)amino]-1-(trifluoromethyl)ethyl]amino}-1,3-benzothiazole-6-carboxylate
Synonyms:
ZINC2336857;STK771416;AKOS005614639;MCULE-3700384311;AG-389/40959612;ethyl 2-({1,1,1,3,3,3-hexafluoro-2-[(3-phenylpropanoyl)amino]propan-2-yl}amino)-1,3-benzothiazole-6-carboxylate;ethyl 2-{[2,2,2-trifluoro-1-[(3-phenylpropanoyl)amino]-1-(trifluoromethyl)ethyl]amino}-1,3-benzothiazole-6-carboxylate

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ethyl 2-{[2,2,2-trifluoro-1-[(3-phenylpropanoyl)amino]-1-(trifluoromethyl)ethyl]amino}-1,3-benzothiazole-6-carboxylate Basic Attributes

Molecular Weight：

519.4599792

Exact Mass：

519.105

Characteristics

PSA：

109

XLogP3：

6.9

Computed Properties

Molecular Weight:519.5
XLogP3:6.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:519.10513162
Monoisotopic Mass:519.10513162
Topological Polar Surface Area:109
Heavy Atom Count:35
Complexity:731
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-{[2,2,2-trifluoro-1-[(3-phenylpropanoyl)amino]-1-(trifluoromethyl)ethyl]amino}-1,3-benzothiazole-6-carboxylate

Basic Attributes
Characteristics
Computed Properties
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