CTK8D5016

methane;3-methyl-2-[2-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylidene]butylidene]-1,3-benzothiazole;bromide

Also Known As: 2-(2-Ethyl-3-(3-methyl-2-benzothiazolylidene)-1-propenyl)-3-methylbenzothiazolium bromide|Benzothiazolium, 3-methyl-2-(2-((3-methyl-2(3H)-benzothiazolylidene)methyl)-1-buten-1-yl)-, bromide, hydrate (1:1:2)|Benzothiazolium, 3-methyl-2-(2-((3-methyl-2(3H)-benzothiazolylidene)methyl)-1-butenyl)-, bromide, dihydrate|3-methyl-2-{2-[(3-methyl-1,3-benzothiazol-2(3h)-ylidene)methyl]but-1-en-1-yl}-1,3-benzothiazol-3-ium bromide methane(1:1:2)|Benzothiazolium, 3-methyl-2-[2-[(3-methyl-2(3H)-benzothiazolylidene)methyl]-1-butenyl]-, bromide, dihydrate|methane; 3-methyl-2-[2-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylidene]butylidene]-1,3-benzothiazole; bromide

Molecular Formula	C23H29BrN2S2
Molecular Weight	476.09555 g/mol
LogP	3.88
Topological Polar Surface Area	7.12 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	476.09555
Heavy Atoms	28
Complexity	1004.8

Chemical Identifiers

CAS Number	19003-87-3
SMILES	C.C.CCC(=CC1=[N+](C2=CC=CC=C2S1)C)C=C3N(C4=CC=CC=C4S3)C.[Br-]