3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(2-methylphenyl)pyrrolidine-2,5-dione

3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(2-methylphenyl)pyrrolidine-2,5-dione

Formula: C20H18N2O3S2

SMILES: CCOC1=CC=C2N=C(SC3CC(=O)N(C3=O)C3=CC=CC=C3C)SC2=C1

IUPAC: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(2-methylphenyl)pyrrolidine-2,5-dione

InChI: InChI=1/C20H18N2O3S2/c1-3-25-13-8-9-14-16(10-13)26-20(21-14)27-17-11-18(23)22(19(17)24)15-7-5-4-6-12(15)2/h4-10,17H,3,11H2,1-2H3

Composition: C (60.28%), H (4.55%), N (7.03%), O (12.04%), S (16.09%)

Molar Mass: 398.5

Atom Count: 45

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	398.075884796
Formal Charge	0
FSP3	0.25
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	FJWSPSHVEHXCLP-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	105.79
Topological Polar Surface Area	59.5
Polarizability	42.32
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H18N2O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00