6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid
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![6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2e55e3b7da7b4212979ab92eafc63a55.png "6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid")
6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid
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CAS No:
124602-20-6
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Formula:
C13H20N2O5S
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Chemical Name:
6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid
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Synonyms:
(3S,6S,9R)-2-oxo-3-t-butyloxycarboxylamino-7-thia-1-aza-bicyclo(4.3.0)nonane-9-carboxylic acid;2-oxo-3-boc-TABNCA;2-oxo-3-tert-butyloxycarbonylamino-7-thia-1-azabicyclo(4.3.0)nonane-9-carboxylic acid;124602-20-6;2-Oxo-3-boc-tabnca;2-Oxo-3-tert-butyloxycarbonylamino-7-thia-1-azabicyclo(4.3.0)nonane-9-carboxylic acid;SCHEMBL3732821;DTXSID80924876;(3R-(3alpha,6alpha,8aalpha))-6-(((1,1-Dimethylethoxy)carbonyl)amino)hexahydro-5-oxo-5H-thiazolo(3,2a)pyridine-3-carboxylic acid;(3S,6S,9R)-2-Oxo-3-t-butyloxycarboxylamino-7-thia-1-aza-bicyclo(4.3.0)nonane-9-carboxylic acid;6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid;6-tert-Butoxycarbonylamino-5-oxo-hexahydro-thiazolo[3,2-a]pyridine-3-carboxylic acid;5H-Thiazolo(3,2a)pyridine-3-carboxylic acid, 6-(((1,1-dimethylethoxy)carbonyl)amino)hexahydro-5-oxo-, (3R-(3alpha,6alpha,8aalpha))-;6-{[tert-Butoxy(hydroxy)methylidene]amino}-5-oxohexahydro-5H-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid
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CAS No:
6-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxo-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid Basic Attributes
316.38 g/mol
316.10929292 g/mol
Drug Information
(3S,6S,9R)-2-oxo-3-t-butyloxycarboxylamino-7-thia-1-aza-bicyclo(4.3.0)nonane-9-carboxylic acid
Computed Properties
Molecular Weight:316.38
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:316.10929292
Monoisotopic Mass:316.10929292
Topological Polar Surface Area:121
Heavy Atom Count:21
Complexity:462
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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