(2E)-2-cyano-3-[4-(dimethylamino)phenyl]-N-(thiophen-2-ylmethyl)prop-2-enamide

(2E)-2-cyano-3-[4-(dimethylamino)phenyl]-N-(thiophen-2-ylmethyl)prop-2-enamide

Formula: C17H17N3OS

SMILES: CN(C)C1=CC=C(C=C(/C#N)C(=O)NCC2=CC=CS2)C=C1

IUPAC: (2E)-2-cyano-3-[4-(dimethylamino)phenyl]-N-[(thiophen-2-yl)methyl]prop-2-enamide

InChI: InChI=1S/C17H17N3OS/c1-20(2)15-7-5-13(6-8-15)10-14(11-18)17(21)19-12-16-4-3-9-22-16/h3-10H,12H2,1-2H3,(H,19,21)/b14-10+

Composition: C (65.57%), H (5.50%), N (13.49%), O (5.14%), S (10.30%)

Molar Mass: 311.4

Atom Count: 39

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	311.109233353
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YUJIGFOGYKTFOP-GXDHUFHOSA-N
Lipinski's Rule of Five	1
Molar Refractivity	90.76
Topological Polar Surface Area	56.13
Polarizability	33.4
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H17N3OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00