3-(5-AMINO-4-BENZOTHIAZOL-2-YL-3-OXO-2,3-DIHYDRO-PYRROL-1-YL)-BENZOIC ACID
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3-(5-AMINO-4-BENZOTHIAZOL-2-YL-3-OXO-2,3-DIHYDRO-PYRROL-1-YL)-BENZOIC ACID
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CAS No:
379726-61-1
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Formula:
C18H13N3O3S
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Chemical Name:
3-(5-AMINO-4-BENZOTHIAZOL-2-YL-3-OXO-2,3-DIHYDRO-PYRROL-1-YL)-BENZOIC ACID
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Synonyms:
3-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2,3-dihydro-1H-pyrrol-1-yl]benzoic acid;3-(5-Amino-4-benzothiazol-2-yl-3-oxo-2,3-dihydro-pyrrol-1-yl)-benzoic acid;CTK7H4315;ZINC3226947;NSC744114;AKOS000117530;CCG-145467;MCULE-3490262475;NE60635;NSC-744114
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CAS No:
3-(5-AMINO-4-BENZOTHIAZOL-2-YL-3-OXO-2,3-DIHYDRO-PYRROL-1-YL)-BENZOIC ACID Basic Attributes
351.38
351.068
744114
Computed Properties
Molecular Weight:351.4
XLogP3:2.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:351.06776246
Monoisotopic Mass:351.06776246
Topological Polar Surface Area:126
Heavy Atom Count:25
Complexity:608
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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