CAS 162374-60-9 | Benzenamine, 4-(2-benzothiazolyl)-2-iodo- | CAS Number 162374-60-9

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Amines > 162374-60-9

162374-60-9 | Benzenamine, 4-(2-benzothiazolyl)-2-iodo-

CAS No: 162374-60-9 Catalog No: AG001T1N MDL No:

Product Description

Catalog Number:

AG001T1N

Chemical Name:

Benzenamine, 4-(2-benzothiazolyl)-2-iodo-

CAS Number:

162374-60-9

Molecular Formula:

C13H9IN2S

Molecular Weight:

352.1934

IUPAC Name:

4-(1,3-benzothiazol-2-yl)-2-iodoaniline

InChI:

InChI=1S/C13H9IN2S/c14-9-7-8(5-6-10(9)15)13-16-11-3-1-2-4-12(11)17-13/h1-7H,15H2

InChI Key:

UZZOZUQVHHJNTR-UHFFFAOYSA-N

SMILES:

Nc1ccc(cc1I)c1nc2c(s1)cccc2

NSC Number:

674496

Properties

Complexity:

276

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

351.953g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

352.193g/mol

Monoisotopic Mass:

351.953g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.2

Literature

Title	Journal
Mechanisms of acquired resistance to 2-(4-Amino-3-methylphenyl)benzothiazole in breast cancer cell lines.	Breast cancer research and treatment 20080701
Antitumour benzothiazoles. Part 15: The synthesis and physico-chemical properties of 2-(4-aminophenyl)benzothiazole sulfamate salt derivatives.	Bioorganic & medicinal chemistry letters 20010423