CAS 98318-77-5 | 1-(2-naphthylmethyl)-1h-imidazole | CAS Number 98318-77-5

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98318-77-5 | 1-(2-naphthylmethyl)-1h-imidazole

CAS No: 98318-77-5 Catalog No: AG0068NI MDL No:

Product Description

Catalog Number:

AG0068NI

Chemical Name:

1-(2-naphthylmethyl)-1h-imidazole

CAS Number:

98318-77-5

Molecular Formula:

C14H12N2

Molecular Weight:

208.2585

IUPAC Name:

1-(naphthalen-2-ylmethyl)imidazole

InChI:

InChI=1S/C14H12N2/c1-2-4-14-9-12(5-6-13(14)3-1)10-16-8-7-15-11-16/h1-9,11H,10H2

InChI Key:

YYUNLYGEACGPFE-UHFFFAOYSA-N

SMILES:

c1ccc2c(c1)cc(cc2)Cn1cncc1

Properties

Complexity:

229

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

208.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

208.264g/mol

Monoisotopic Mass:

208.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9

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