1,3-benzothiazol-2-ylmethyl 3-(4-nitro-1,3-dioxoisoindol-2-yl)propanoate
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1,3-benzothiazol-2-ylmethyl 3-(4-nitro-1,3-dioxoisoindol-2-yl)propanoate
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CAS No:
753478-18-1
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Formula:
C19H13N3O6S
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Chemical Name:
1,3-benzothiazol-2-ylmethyl 3-(4-nitro-1,3-dioxoisoindol-2-yl)propanoate
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Synonyms:
ZINC2659102;AKOS033779411;MCULE-4794027548;Z21646123;(1,3-benzothiazol-2-yl)methyl 3-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoate;753478-18-1
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CAS No:
1,3-benzothiazol-2-ylmethyl 3-(4-nitro-1,3-dioxoisoindol-2-yl)propanoate Basic Attributes
411.4 g/mol
411.05250632 g/mol
Computed Properties
Molecular Weight:411.4
XLogP3:2.5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:411.05250632
Monoisotopic Mass:411.05250632
Topological Polar Surface Area:151
Heavy Atom Count:29
Complexity:698
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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