1-(1-benzylpiperidin-4-yl)-4-[(3-bromo-4-methoxyphenyl)methyl]piperazine

1-(1-benzylpiperidin-4-yl)-4-[(3-bromo-4-methoxyphenyl)methyl]piperazine

Formula: C24H32BrN3O

SMILES: COC1=CC=C(CN2CCN(CC2)C2CCN(CC3=CC=CC=C3)CC2)C=C1Br

IUPAC: 1-(1-benzylpiperidin-4-yl)-4-[(3-bromo-4-methoxyphenyl)methyl]piperazine

InChI: InChI=1S/C24H32BrN3O/c1-29-24-8-7-21(17-23(24)25)19-27-13-15-28(16-14-27)22-9-11-26(12-10-22)18-20-5-3-2-4-6-20/h2-8,17,22H,9-16,18-19H2,1H3

Composition: C (62.88%), H (7.04%), Br (17.43%), N (9.17%), O (3.49%)

Molar Mass: 458.444

Atom Count: 61

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	457.172876
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	RUZMGYWPPNONJO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	124.8
Topological Polar Surface Area	18.95
Polarizability	48.47
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H32BrN3O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00