(2E)-3-(2H-1,3-benzodioxol-5-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)prop-2-enamide

(2E)-3-(2H-1,3-benzodioxol-5-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)prop-2-enamide

Formula: C18H14N2O3S

SMILES: CC1=CC=C2N=C(NC(=O)C=CC3=CC=C4OCOC4=C3)SC2=C1

IUPAC: (2E)-3-(2H-1,3-benzodioxol-5-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)prop-2-enamide

InChI: InChI=1S/C18H14N2O3S/c1-11-2-5-13-16(8-11)24-18(19-13)20-17(21)7-4-12-3-6-14-15(9-12)23-10-22-14/h2-9H,10H2,1H3,(H,19,20,21)/b7-4+

Composition: C (63.89%), H (4.17%), N (8.28%), O (14.18%), S (9.47%)

Molar Mass: 338.38

Atom Count: 38

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	338.072513493
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	PHKCFJJKKFIYQZ-QPJJXVBHSA-N
Lipinski's Rule of Five	1
Molar Refractivity	92.69
Topological Polar Surface Area	60.45
Polarizability	35.92
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H14N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00