(2E)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-[4-(prop-2-yn-1-yloxy)phenyl]prop-2-enamide

(2E)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-[4-(prop-2-yn-1-yloxy)phenyl]prop-2-enamide

Formula: C23H19N3O2

SMILES: O=C(NCCC1=CNC2=CC=CC=C12)C(=CC1=CC=C(OCC#C)C=C1)C#N

IUPAC: (2E)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]-3-[4-(prop-2-yn-1-yloxy)phenyl]prop-2-enamide

InChI: InChI=1S/C23H19N3O2/c1-2-13-28-20-9-7-17(8-10-20)14-19(15-24)23(27)25-12-11-18-16-26-22-6-4-3-5-21(18)22/h1,3-10,14,16,26H,11-13H2,(H,25,27)/b19-14+

Composition: C (74.78%), H (5.18%), N (11.37%), O (8.66%)

Molar Mass: 369.424

Atom Count: 47

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	369.147726864
Formal Charge	0
FSP3	0.13
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	JIVOXXUHLWTCCW-XMHGGMMESA-N
Lipinski's Rule of Five	1
Molar Refractivity	109.33
Topological Polar Surface Area	77.91
Polarizability	42.1
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H19N3O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00