(2E)-N-(3-chlorophenyl)-2-cyano-3-[4-(piperidin-1-yl)phenyl]prop-2-enamide

(2E)-N-(3-chlorophenyl)-2-cyano-3-[4-(piperidin-1-yl)phenyl]prop-2-enamide

Formula: C21H20ClN3O

SMILES: ClC1=CC(NC(=O)C(=CC2=CC=C(C=C2)N2CCCCC2)C#N)=CC=C1

IUPAC: (2E)-N-(3-chlorophenyl)-2-cyano-3-[4-(piperidin-1-yl)phenyl]prop-2-enamide

InChI: InChI=1S/C21H20ClN3O/c22-18-5-4-6-19(14-18)24-21(26)17(15-23)13-16-7-9-20(10-8-16)25-11-2-1-3-12-25/h4-10,13-14H,1-3,11-12H2,(H,24,26)/b17-13+

Composition: C (68.94%), H (5.51%), Cl (9.69%), N (11.49%), O (4.37%)

Molar Mass: 365.86

Atom Count: 46

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	365.12949
Formal Charge	0
FSP3	0.24
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	FVBITXPTLUNUTH-GHRIWEEISA-N
Lipinski's Rule of Five	1
Molar Refractivity	107.77
Topological Polar Surface Area	56.13
Polarizability	39.56
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H20ClN3O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00