2-(BENZOTHIAZOL-2-YLAMINO)-4-METHYLSULFANYL-BUTYRIC ACID
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2-(BENZOTHIAZOL-2-YLAMINO)-4-METHYLSULFANYL-BUTYRIC ACID
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CAS No:
436810-97-8
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Formula:
C12H14N2O2S2
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Chemical Name:
2-(BENZOTHIAZOL-2-YLAMINO)-4-METHYLSULFANYL-BUTYRIC ACID
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Synonyms:
2-(Benzothiazol-2-ylamino)-4-methylsulfanyl-butyric acid;2-(benzothiazol-2-ylamino)-4-methylsulfanylbutyric acid;2-(Benzothiazol-2-ylamino)-4-methylsulfanylbutyricacid;2-(Benzo[d]thiazol-2-ylamino)-4-(methylthio)butanoic acid;2-(1,3-benzothiazol-2-ylamino)-4-(methylthio)butanoic acid;2-(benzothiazol-2-ylamino)-4-methylthiobutanoic acid;BAS 00280985;SMR000001304;Oprea1_090519;Oprea1_595965
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CAS No:
2-(BENZOTHIAZOL-2-YLAMINO)-4-METHYLSULFANYL-BUTYRIC ACID Basic Attributes
282.38
282.05000
DTXSID10349533
2934200090
Computed Properties
Molecular Weight:282.4
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:282.04967004
Monoisotopic Mass:282.04967004
Topological Polar Surface Area:116
Heavy Atom Count:18
Complexity:291
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-(BENZOTHIAZOL-2-YLAMINO)-4-METHYLSULFANYL-BUTYRIC ACID
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