CAS 1504-16-1 | 1H-Indole, 3-phenyl- | CAS Number 1504-16-1

200,000+ products from a single source!

sales@angenechem.com

Product Categories

Home > Indoles and Oxindole > 1504-16-1

1504-16-1 | 1H-Indole, 3-phenyl-

CAS No: 1504-16-1 Catalog No: AG001ML3 MDL No:

Product Description

Catalog Number:

AG001ML3

Chemical Name:

1H-Indole, 3-phenyl-

CAS Number:

1504-16-1

Molecular Formula:

C14H11N

Molecular Weight:

193.2438

IUPAC Name:

3-phenyl-1H-indole

InChI:

InChI=1S/C14H11N/c1-2-6-11(7-3-1)13-10-15-14-9-5-4-8-12(13)14/h1-10,15H

InChI Key:

XZNGTBLWFCRXKR-UHFFFAOYSA-N

SMILES:

c1ccc(cc1)c1c[nH]c2c1cccc2

UNII:

7676CPK41G

NSC Number:

76690

Properties

Complexity:

207

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.249g/mol

Monoisotopic Mass:

193.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

15.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9

Literature

Title	Journal
Structure of the indole-benzene dimer revisited.	The journal of physical chemistry. A 20110901
Accurately characterizing the pi-pi interaction energies of indole-benzene complexes.	The journal of physical chemistry. A 20100318
Substrate specificity and inhibition of brassinin hydrolases, detoxifying enzymes from the plant pathogens Leptosphaeria maculans and Alternaria brassicicola.	The FEBS journal 20091201
The synthesis of 2- and 3-aryl indoles and 1,3,4,5-tetrahydropyrano[4,3-b]indoles and their antibacterial and antifungal activity.	Bioorganic & medicinal chemistry letters 20090901
Synthetic inhibitors of the fungal detoxifying enzyme brassinin oxidase based on the phytoalexin camalexin scaffold.	Journal of agricultural and food chemistry 20090325
Cloning, purification and characterisation of brassinin glucosyltransferase, a phytoalexin-detoxifying enzyme from the plant pathogen Sclerotinia sclerotiorum.	Fungal genetics and biology : FG & B 20090201
Methyl 3-(4-bromo-phen-yl)-2-(1H-indol-3-ylmeth-yl)-5-[1-(4-methoxy-phen-yl)-4-oxo-2-phenyl-azetidin-2-yl]-4-nitro-pyrrolidine-2-carboxyl-ate.	Acta crystallographica. Section E, Structure reports online 20080601
Design, synthesis, and evaluation of potential inhibitors of brassinin glucosyltransferase, a phytoalexin detoxifying enzyme from Sclerotinia sclerotiorum.	Bioorganic & medicinal chemistry 20070901
Camalexin induces detoxification of the phytoalexin brassinin in the plant pathogen Leptosphaeria maculans.	Phytochemistry 20051101
Protein engineering of toluene ortho-monooxygenase of Burkholderia cepacia G4 for regiospecific hydroxylation of indole to form various indigoid compounds.	Applied microbiology and biotechnology 20050101
Synthesis and antitumor activity of substituted 3-(5-imidazo[2,1-b]thiazolylmethylene)-2-indolinones.	Anti-cancer drug design 20010101