 Home > Encyclopedia > 3-ethyl-2-[3-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5-phenyl-1,3-benzoxazole

3-ethyl-2-[3-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5-phenyl-1,3-benzoxazole

3-ethyl-2-[3-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5-phenyl-1,3-benzoxazole structure

CAS No:
47747-80-8
Formula:
C30H31N2OS+
Chemical Name:
3-ethyl-2-[3-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5-phenyl-1,3-benzoxazole
Synonyms:
ZINC03121970;DTXSID30367931;29133-40-2;3-Ethyl-2-[3-(3-ethyl-5,6-dimethylbenzothiazol-2(3H)-ylidene)-2-methyl-1-propenyl]-5-phenylbenzoxazolium

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3-ethyl-2-[3-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5-phenyl-1,3-benzoxazole Basic Attributes

Molecular Weight：

467.6 g/mol

Exact Mass：

467.21570979 g/mol

DSSTox ID：

DTXSID30367931

Characteristics

PSA：

44.6 Å²

Computed Properties

Molecular Weight:467.6
XLogP3:8.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:467.21570979
Monoisotopic Mass:467.21570979
Topological Polar Surface Area:44.6
Heavy Atom Count:34
Formal Charge:1
Complexity:759
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-ethyl-2-[3-(3-ethyl-5,6-dimethyl-1,3-benzothiazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5-phenyl-1,3-benzoxazole

Basic Attributes
Characteristics
Computed Properties

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