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methyl 4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzoate

methyl 4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzoate structure

CAS No:
522626-25-1
Formula:
C16H12N2O4S2
Chemical Name:
methyl 4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzoate
Synonyms:
methyl 4-{[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]methyl}benzoate;ZINC3247670;STK409529;AKOS002325700;MCULE-7320263902;ST50814397;Z19125538;methyl 4-[(6-nitrobenzothiazol-2-ylthio)methyl]benzoate;522626-25-1

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methyl 4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzoate Basic Attributes

Molecular Weight：

360.4 g/mol

Exact Mass：

360.02384922 g/mol

Characteristics

PSA：

139 Å²

Computed Properties

Molecular Weight:360.4
XLogP3:4.4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:360.02384922
Monoisotopic Mass:360.02384922
Topological Polar Surface Area:139
Heavy Atom Count:24
Complexity:466
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl 4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]benzoate

Basic Attributes
Characteristics
Computed Properties
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