4-benzyl-1-(4-{[(4-chlorophenyl)sulfanyl]methyl}benzoyl)piperidine

4-benzyl-1-(4-{[(4-chlorophenyl)sulfanyl]methyl}benzoyl)piperidine

Formula: C26H26ClNOS

SMILES: ClC1=CC=C(SCC2=CC=C(C=C2)C(=O)N2CCC(CC3=CC=CC=C3)CC2)C=C1

IUPAC: 4-benzyl-1-(4-{[(4-chlorophenyl)sulfanyl]methyl}benzoyl)piperidine

InChI: InChI=1S/C26H26ClNOS/c27-24-10-12-25(13-11-24)30-19-22-6-8-23(9-7-22)26(29)28-16-14-21(15-17-28)18-20-4-2-1-3-5-20/h1-13,21H,14-19H2

Composition: C (71.62%), H (6.01%), Cl (8.13%), N (3.21%), O (3.67%), S (7.35%)

Molar Mass: 436.01

Atom Count: 56

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	435.1423633
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	FDLZBJHEZKEONG-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	128.54
Topological Polar Surface Area	20.31
Polarizability	49.35
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H26ClNOS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00