1-[5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2,6-dioxopiperidin-3-yl]-1??-pyridin-1-ylium

1-[5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2,6-dioxopiperidin-3-yl]-1??-pyridin-1-ylium

Formula: C18H16N3O4

SMILES: COC1=CC(=CC=C1O)C1C(C#N)C(=O)NC(=O)C1[N+]1=CC=CC=C1

IUPAC: 1-[5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2,6-dioxopiperidin-3-yl]-1??-pyridin-1-ylium

InChI: InChI=1/C18H15N3O4/c1-25-14-9-11(5-6-13(14)22)15-12(10-19)17(23)20-18(24)16(15)21-7-3-2-4-8-21/h2-9,12,15-16H,1H3,(H-,20,22,23,24)/p+1

Composition: C (63.90%), H (4.77%), N (12.42%), O (18.91%)

Molar Mass: 338.342

Atom Count: 41

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	3
Exact Mass	338.113532427
Formal Charge	1
FSP3	0.22
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	MDNYYRFXZQVXDF-UHFFFAOYNA-O
Lipinski's Rule of Five	1
Molar Refractivity	88.45
Topological Polar Surface Area	103.3
Polarizability	33.87
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H16N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00