4-{4-[(2-oxo-1H-indol-3-ylidene)methyl]phenyl}piperazine-1-carbaldehyde

4-{4-[(2-oxo-1H-indol-3-ylidene)methyl]phenyl}piperazine-1-carbaldehyde

CAS: 186610-89-9

Formula: C20H19N3O2

SMILES: O=CN1CCN(CC1)C1=CC=C(C=C2C(=O)NC3=C2C=CC=C3)C=C1

IUPAC: 4-{4-[(2-oxo-2,3-dihydro-1H-indol-3-ylidene)methyl]phenyl}piperazine-1-carbaldehyde

InChI: InChI=1S/C20H19N3O2/c24-14-22-9-11-23(12-10-22)16-7-5-15(6-8-16)13-18-17-3-1-2-4-19(17)21-20(18)25/h1-8,13-14H,9-12H2,(H,21,25)

Composition: C (72.05%), H (5.74%), N (12.60%), O (9.60%)

Molar Mass: 333.391

Atom Count: 44

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	333.147726864
Formal Charge	0
FSP3	0.2
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZNFJBJDODKHWED-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	99.99
Topological Polar Surface Area	52.65
Polarizability	36.48
Ring Count	4
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
99.94%	<7 Days	186610-89-9		$65.45-$701.25$65.45$112.20$233.75$420.75$701.25