CAS 872696-02-1 | 4-Ethoxy-2-hydrazino-1,3-benzothiazole | CAS Number 872696-02-1

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872696-02-1 | 4-Ethoxy-2-hydrazino-1,3-benzothiazole

CAS No: 872696-02-1 Catalog No: AG01FN04 MDL No:MFCD04448796

Product Description

Catalog Number:

AG01FN04

Chemical Name:

4-Ethoxy-2-hydrazino-1,3-benzothiazole

CAS Number:

872696-02-1

Molecular Formula:

C9H11N3OS

Molecular Weight:

209.2681

MDL Number:

MFCD04448796

IUPAC Name:

(4-ethoxy-1,3-benzothiazol-2-yl)hydrazine

InChI:

InChI=1S/C9H11N3OS/c1-2-13-6-4-3-5-7-8(6)11-9(12-10)14-7/h3-5H,2,10H2,1H3,(H,11,12)

InChI Key:

JMUUSQSFBDDCHL-UHFFFAOYSA-N

SMILES:

CCOc1cccc2c1nc(s2)NN

Properties

Complexity:

193

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

209.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

209.267g/mol

Monoisotopic Mass:

209.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501