Name: Name:1H-Pyrrole-2,5-dione, 1-[4-(6-methyl-2-benzothiazolyl)phenyl]-
Brand: Angene
SKU: AG002AS0
Rating: 90 (10 reviews)

1H-Pyrrole-2,5-dione, 1-[4-(6-methyl-2-benzothiazolyl)phenyl]-

CAS No.:

19735-68-3

Catalog Number:

AG002AS0

Molecular Formula:

C18H12N2O2S

Molecular Weight:

320.3651

Catalog Number:

AG002AS0

Chemical Name:

1H-Pyrrole-2,5-dione, 1-[4-(6-methyl-2-benzothiazolyl)phenyl]-

CAS Number:

19735-68-3

Molecular Formula:

C18H12N2O2S

Molecular Weight:

320.3651

MDL Number:

MFCD00554973

IUPAC Name:

1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]pyrrole-2,5-dione

InChI:

InChI=1S/C18H12N2O2S/c1-11-2-7-14-15(10-11)23-18(19-14)12-3-5-13(6-4-12)20-16(21)8-9-17(20)22/h2-10H,1H3

InChI Key:

CZQCIQYROQWOQJ-UHFFFAOYSA-N

SMILES:

Cc1ccc2c(c1)sc(n2)c1ccc(cc1)N1C(=O)C=CC1=O

Complexity:

509

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

320.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

320.366g/mol

Monoisotopic Mass:

320.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5