4-{4-[(R)-(4-chlorophenyl)(pyridin-2-yl)methoxy]piperidin-1-yl}butanoic acid

4-{4-[(R)-(4-chlorophenyl)(pyridin-2-yl)methoxy]piperidin-1-yl}butanoic acid

CAS: 190730-41-7

Formula: C21H25ClN2O3

SMILES: OC(=O)CCCN1CCC(CC1)O[C@H](C1=CC=C(Cl)C=C1)C1=CC=CC=N1

IUPAC: 4-{4-[(R)-(4-chlorophenyl)(pyridin-2-yl)methoxy]piperidin-1-yl}butanoic acid

InChI: InChI=1S/C21H25ClN2O3/c22-17-8-6-16(7-9-17)21(19-4-1-2-12-23-19)27-18-10-14-24(15-11-18)13-3-5-20(25)26/h1-2,4,6-9,12,18,21H,3,5,10-11,13-15H2,(H,25,26)/t21-/m1/s1

Composition: C (64.86%), H (6.48%), Cl (9.12%), N (7.20%), O (12.34%)

Molar Mass: 388.89

Atom Count: 52

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	388.1553704
Formal Charge	0
FSP3	0.43
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	YWGDOWXRIALTES-OAQYLSRUSA-N
Lipinski's Rule of Five	1
Molar Refractivity	105.1
Topological Polar Surface Area	62.66
Polarizability	41.3
Ring Count	3
Rotatable Bond Count	8

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<5 Days	190730-41-7		$363.17-$1,400.97$363.17$561.15$1,400.97