3,6-Bis[2-(4-pyridinyl)ethenyl]-9H-carbazole - CAS 846042-18-0

Catalog:	BB073114
Product Name:	3,6-Bis[2-(4-pyridinyl)ethenyl]-9H-carbazole
CAS:	846042-18-0
Synonyms:	3,6-bis(2-pyridin-4-ylethenyl)-9H-carbazole; 9H-Carbazole, 3,6-bis[2-(4-pyridinyl)ethenyl]-; 3,6-Bis[2-(4-pyridinyl)ethenyl]-9H-carbazole

Technical Data

IUPAC Name:	3,6-bis(2-pyridin-4-ylethenyl)-9H-carbazole
Description:	3,6-Bis[2-(4-pyridinyl)ethenyl]-9H-carbazole is an carbazole based intermediate in the synthesis of potential antitumor agents and fluorescence marker of cancer cells.
Molecular Weight:	373.45
Molecular Formula:	C26H19N3
Canonical SMILES:	C1=CC2=C(C=C1C=CC3=CC=NC=C3)C4=C(N2)C=CC(=C4)C=CC5=CC=NC=C5
InChI:	InChI=1S/C26H19N3/c1(19-9-13-27-14-10-19)3-21-5-7-25-23(17-21)24-18-22(6-8-26(24)29-25)4-2-20-11-15-28-16-12-20/h1-18,29H
InChI Key:	IFNNQOFEVUUCBL-UHFFFAOYSA-N
Melting Point:	>215°C (dec.)
Solubility:	DMSO (Slightly), Methanol (Slightly)
Appearance:	Yellow to Brown Solid
Storage:	-20°C, Light sensitive
References:	Chang, C. C., et al. Chem. Biodiver., 1, 1377 (2004).

Complexity:	523
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	373.157897619
Formal Charge:	0
Heavy Atom Count:	29
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	373.157897619
Rotatable Bond Count:	4
Topological Polar Surface Area:	41.6Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	2
XLogP3:	5.8