AC1NQYM5 structure

AC1NQYM5

5-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy-(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione

Also Known As: 5-(3-Bromo-4-hydroxy-5-methoxyphenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione|5-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy-(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione

CAS: 7018-60-2
Molecular Formula C28H23BrN2O6S
Molecular Weight 594.046 g/mol
LogP 6.02474
Topological Polar Surface Area 109.19 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 8
Rotatable Bonds 5
Exact Mass 594.046
Monoisotopic Mass 594.046
Heavy Atoms 38
Complexity 1660.8536

Chemical Identifiers

CAS Number 7018-60-2
SMILES CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C4=CC(=CC=C4)OC)O)C(=O)C3=O)C5=CC(=C(C(=C5)Br)O)OC)C

Product Overview

AC1NQYM5 (CAS 7018-60-2), with molecular formula C28H23BrN2O6S and molecular weight 594.046 g/mol. IUPAC: 5-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy-(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione.

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