4-[(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzoic acid
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![4-[(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f55e8371df6149c2a3e95ef515099dbd.png "4-[(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzoic acid")
4-[(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzoic acid
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CAS No:
556014-66-5
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Formula:
C17H13N3O2S
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Chemical Name:
4-[(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzoic acid
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Synonyms:
HMS2766A13;AKOS034412253;MCULE-5541831631;Z49907453;4-{[(4-phenyl-2-sulfanyl-1H-imidazol-1-yl)imino]methyl}benzoic acid;556014-66-5
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CAS No:
4-[(5-phenyl-2-sulfanylidene-1H-imidazol-3-yl)iminomethyl]benzoic acid Basic Attributes
323.4 g/mol
323.07284784 g/mol
Computed Properties
Molecular Weight:323.4
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:323.07284784
Monoisotopic Mass:323.07284784
Topological Polar Surface Area:97
Heavy Atom Count:23
Complexity:518
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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