CAS 82928-10-7 | 2-(Benzo[d]thiazol-2-yl)ethanamine | CAS Number 82928-10-7

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82928-10-7 | 2-(Benzo[d]thiazol-2-yl)ethanamine

CAS No: 82928-10-7 Catalog No: AG005EOX MDL No:MFCD00068158

Product Description

Catalog Number:

AG005EOX

Chemical Name:

2-(Benzo[d]thiazol-2-yl)ethanamine

CAS Number:

82928-10-7

Molecular Formula:

C9H10N2S

Molecular Weight:

178.2541

MDL Number:

MFCD00068158

IUPAC Name:

2-(1,3-benzothiazol-2-yl)ethanamine

InChI:

InChI=1S/C9H10N2S/c10-6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5-6,10H2

InChI Key:

HLTRQIYNHRBUNW-UHFFFAOYSA-N

SMILES:

NCCc1nc2c(s1)cccc2

Properties

Complexity:

152

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

178.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

178.253g/mol

Monoisotopic Mass:

178.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

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