2-(2H-1,3-benzodioxol-5-yl)-N-(4,5-dihydro-1,3-thiazol-2-yl)quinoline-4-carboxamide

2-(2H-1,3-benzodioxol-5-yl)-N-(4,5-dihydro-1,3-thiazol-2-yl)quinoline-4-carboxamide

Formula: C20H15N3O3S

SMILES: O=C(NC1=NCCS1)C1=CC(=NC2=CC=CC=C12)C1=CC=C2OCOC2=C1

IUPAC: 2-(2H-1,3-benzodioxol-5-yl)-N-(4,5-dihydro-1,3-thiazol-2-yl)quinoline-4-carboxamide

InChI: InChI=1S/C20H15N3O3S/c24-19(23-20-21-7-8-27-20)14-10-16(22-15-4-2-1-3-13(14)15)12-5-6-17-18(9-12)26-11-25-17/h1-6,9-10H,7-8,11H2,(H,21,23,24)

Composition: C (63.65%), H (4.01%), N (11.13%), O (12.72%), S (8.49%)

Molar Mass: 377.42

Atom Count: 42

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	377.083412529
Formal Charge	0
FSP3	0.15
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	HXOLHCYDRAOITO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	102.26
Topological Polar Surface Area	72.81
Polarizability	41.81
Ring Count	5
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H15N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00