2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylbenzoic acid
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2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylbenzoic acid
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CAS No:
540773-86-2
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Formula:
C21H15NO3S2
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Chemical Name:
2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylbenzoic acid
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Synonyms:
2-{[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]sulfanyl}benzoic acid;MLS000418633;2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylbenzoic acid;SMR000247547;540773-86-2;Oprea1_524549;CHEMBL1562764;BDBM42250;cid_2385059;HMS2537K23;ZINC3268695;STL266062;AKOS000121796;MCULE-9759666022;NE60512;EN300-00244;Z56854627;2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]benzoic acid;2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]benzoic acid;2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanylbenzoic acid
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CAS No:
2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylbenzoic acid Basic Attributes
393.5 g/mol
393.04933569 g/mol
Computed Properties
Molecular Weight:393.5
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:393.04933569
Monoisotopic Mass:393.04933569
Topological Polar Surface Area:108
Heavy Atom Count:27
Complexity:536
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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