2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl 2-(furan-2-yl)quinoline-4-carboxylate

2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl 2-(furan-2-yl)quinoline-4-carboxylate

Formula: C25H21N3O6

SMILES: O=C(COC(=O)C1=CC(=NC2=CC=CC=C12)C1=CC=CO1)N1CCN(CC1)C(=O)C1=CC=CO1

IUPAC: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl 2-(furan-2-yl)quinoline-4-carboxylate

InChI: InChI=1S/C25H21N3O6/c29-23(27-9-11-28(12-10-27)24(30)22-8-4-14-33-22)16-34-25(31)18-15-20(21-7-3-13-32-21)26-19-6-2-1-5-17(18)19/h1-8,13-15H,9-12,16H2

Composition: C (65.35%), H (4.61%), N (9.15%), O (20.89%)

Molar Mass: 459.458

Atom Count: 55

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	459.143035408
Formal Charge	0
FSP3	0.2
Hetero Ring Count	4
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	HMSBOTBYKOECEA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	120.24
Topological Polar Surface Area	106.09
Polarizability	48.19
Ring Count	5
Rotatable Bond Count	6

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C25H21N3O6		Quote Only