1-(4-ethoxyphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione

1-(4-ethoxyphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione

Formula: C16H15N3O3S

SMILES: CCOC1=CC=C(C=C1)N1C(=O)CC(SC2=NC=CC=N2)C1=O

IUPAC: 1-(4-ethoxyphenyl)-3-(pyrimidin-2-ylsulfanyl)pyrrolidine-2,5-dione

InChI: InChI=1/C16H15N3O3S/c1-2-22-12-6-4-11(5-7-12)19-14(20)10-13(15(19)21)23-16-17-8-3-9-18-16/h3-9,13H,2,10H2,1H3

Composition: C (58.35%), H (4.59%), N (12.76%), O (14.57%), S (9.73%)

Molar Mass: 329.37

Atom Count: 38

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	329.083412529
Formal Charge	0
FSP3	0.25
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	JKRHYAAWAHXBDG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.82
Topological Polar Surface Area	72.39
Polarizability	33.5
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H15N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00