N-[(1Z)-1-chloro-1-(4-methoxyphenyl)-3-oxo-3-(piperidin-1-yl)prop-1-en-2-yl]benzamide

N-[(1Z)-1-chloro-1-(4-methoxyphenyl)-3-oxo-3-(piperidin-1-yl)prop-1-en-2-yl]benzamide

CAS: 1323140-64-2

Formula: C22H23ClN2O3

SMILES: COC1=CC=C(C=C1)C(Cl)=C(NC(=O)C1=CC=CC=C1)C(=O)N1CCCCC1

IUPAC: N-[(1Z)-1-chloro-1-(4-methoxyphenyl)-3-oxo-3-(piperidin-1-yl)prop-1-en-2-yl]benzamide

InChI: InChI=1S/C22H23ClN2O3/c1-28-18-12-10-16(11-13-18)19(23)20(22(27)25-14-6-3-7-15-25)24-21(26)17-8-4-2-5-9-17/h2,4-5,8-13H,3,6-7,14-15H2,1H3,(H,24,26)/b20-19-

Composition: C (66.24%), H (5.81%), Cl (8.89%), N (7.02%), O (12.03%)

Molar Mass: 398.89

Atom Count: 51

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	398.1397203
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	FAZSNTAOGNSKDI-VXPUYCOJSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.74
Topological Polar Surface Area	58.64
Polarizability	42.07
Ring Count	3
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1323140-64-2		$325.34-$674.64$325.34$551.06$674.64