Necrostatin-5
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Necrostatin-5
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CAS No:
337349-54-9
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Formula:
C19H17N3O2S2
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Chemical Name:
Necrostatin-5
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Synonyms:
Necrostatin-5;Necrostatin-5 (Nec-5);2-[[3,4,5,6,7,8-Hexahydro-3-(4-methoxyphenyl)-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl]thio]-acetonitrile;3-p-methoxyphenyl-5,6-tetramethylenothieno[2,3-d]pyrimidin-4-one-2-mercaptoethylcyanide;Acetonitrile, 2-[[3,4,5,6,7,8-hexahydro-3-(4-methoxyphenyl)-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl]thio]-;Necrostatin-5 >=98% (HPLC), solid
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CAS No:
Safety Information
3
36
26
Xi
|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P273, P280, P305+P351+P338, P337+P313, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:383.5
XLogP3:4.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:383.07621914
Monoisotopic Mass:383.07621914
Topological Polar Surface Area:119
Heavy Atom Count:26
Complexity:624
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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