3-[4-(2H-1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(2-methoxyphenyl)pyrrolidine-2,5-dione

3-[4-(2H-1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(2-methoxyphenyl)pyrrolidine-2,5-dione

Formula: C23H25N3O5

SMILES: COC1=CC=CC=C1N1C(=O)CC(N2CCN(CC3=CC=C4OCOC4=C3)CC2)C1=O

IUPAC: 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-1-(2-methoxyphenyl)pyrrolidine-2,5-dione

InChI: InChI=1/C23H25N3O5/c1-29-19-5-3-2-4-17(19)26-22(27)13-18(23(26)28)25-10-8-24(9-11-25)14-16-6-7-20-21(12-16)31-15-30-20/h2-7,12,18H,8-11,13-15H2,1H3

Composition: C (65.24%), H (5.95%), N (9.92%), O (18.89%)

Molar Mass: 423.469

Atom Count: 56

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	423.179420917
Formal Charge	0
FSP3	0.39
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
InChIKey	XVWOQMWELAODPL-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	112.91
Topological Polar Surface Area	71.55
Polarizability	44.36
Ring Count	5
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H25N3O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00