(2E)-3-(2H-1,3-benzodioxol-5-yl)-N-(2,5-dimethoxyphenyl)prop-2-enamide

(2E)-3-(2H-1,3-benzodioxol-5-yl)-N-(2,5-dimethoxyphenyl)prop-2-enamide

Formula: C18H17NO5

SMILES: COC1=CC=C(OC)C(NC(=O)C=CC2=CC=C3OCOC3=C2)=C1

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

InChI: InChI=1S/C18H17NO5/c1-21-13-5-7-15(22-2)14(10-13)19-18(20)8-4-12-3-6-16-17(9-12)24-11-23-16/h3-10H,11H2,1-2H3,(H,19,20)/b8-4+

Composition: C (66.05%), H (5.23%), N (4.28%), O (24.44%)

Molar Mass: 327.336

Atom Count: 41

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	327.110672651
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	CWFPUIQUHKHYLD-XBXARRHUSA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.03
Topological Polar Surface Area	66.02
Polarizability	33.91
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H17NO5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00