{[1-(3-chloro-4-fluorobenzoyl)-4-fluoropiperidin-4-yl]methyl}[2-(pyridin-2-yloxy)ethyl]amine hydrochloride

{[1-(3-chloro-4-fluorobenzoyl)-4-fluoropiperidin-4-yl]methyl}[2-(pyridin-2-yloxy)ethyl]amine hydrochloride

Formula: C20H23Cl2F2N3O2

SMILES: Cl[H].FC1=CC=C(C=C1Cl)C(=O)N1CCC(F)(CNCCOC2=NC=CC=C2)CC1

IUPAC: {[1-(3-chloro-4-fluorobenzoyl)-4-fluoropiperidin-4-yl]methyl}[2-(pyridin-2-yloxy)ethyl]amine hydrochloride

InChI: InChI=1S/C20H22ClF2N3O2.ClH/c21-16-13-15(4-5-17(16)22)19(27)26-10-6-20(23,7-11-26)14-24-9-12-28-18-3-1-2-8-25-18;/h1-5,8,13,24H,6-7,9-12,14H2;1H

Composition: C (53.82%), H (5.19%), Cl (15.89%), F (8.51%), N (9.41%), O (7.17%)

Molar Mass: 446.32

Atom Count: 52

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	445.1135387
Formal Charge	0
FSP3	0.4
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ANOJKCJEWKVZDV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	103.31
Topological Polar Surface Area	54.46
Polarizability	39.42
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molnova Chemicals

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
98%	<4 Days	C20H23Cl2F2N3O2		$170.75-$851.89$170.75$285.15$402.00$585.48$851.89