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ethyl 2-(1,3-benzothiazol-2-ylamino)-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate

ethyl 2-(1,3-benzothiazol-2-ylamino)-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate structure

CAS No:
256325-80-1
Formula:
C18H15F3N4O3S
Chemical Name:
ethyl 2-(1,3-benzothiazol-2-ylamino)-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate
Synonyms:
STK528692;AKOS005461843;MCULE-5466765993;AG-390/34639004;Ethyl 2-(2-benzothiazolylamino)-3,3,3-trifluoro-2-nicotinamidopropionate;ethyl 2-(1,3-benzothiazol-2-ylamino)-3,3,3-trifluoro-N-(pyridin-3-ylcarbonyl)alaninate;256325-80-1;Ethyl 2-(1,3-benzothiazol-2-ylamino)-3,3,3-trifluoro-2-[(3-pyridinylcarbonyl)amino]propanoate;Ethyl 2-(1,3-benzothiazol-2-ylamino)-3,3,3-trifluoro-2-[(3-pyridinylcarbonyl)amino]propanoate #

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ethyl 2-(1,3-benzothiazol-2-ylamino)-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate Basic Attributes

Molecular Weight：

424.4 g/mol

Exact Mass：

424.08169601 g/mol

Characteristics

PSA：

121 Å²

Computed Properties

Molecular Weight:424.4
XLogP3:4.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:7
Exact Mass:424.08169601
Monoisotopic Mass:424.08169601
Topological Polar Surface Area:121
Heavy Atom Count:29
Complexity:609
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-(1,3-benzothiazol-2-ylamino)-3,3,3-trifluoro-2-(pyridine-3-carbonylamino)propanoate

Basic Attributes
Characteristics
Computed Properties
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