1-[(3-bromo-4-methoxyphenyl)methyl]-4-(2-fluorobenzoyl)piperazine

1-[(3-bromo-4-methoxyphenyl)methyl]-4-(2-fluorobenzoyl)piperazine

Formula: C19H20BrFN2O2

SMILES: COC1=CC=C(CN2CCN(CC2)C(=O)C2=CC=CC=C2F)C=C1Br

IUPAC: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-(2-fluorobenzoyl)piperazine

InChI: InChI=1S/C19H20BrFN2O2/c1-25-18-7-6-14(12-16(18)20)13-22-8-10-23(11-9-22)19(24)15-4-2-3-5-17(15)21/h2-7,12H,8-11,13H2,1H3

Composition: C (56.03%), H (4.95%), Br (19.62%), F (4.66%), N (6.88%), O (7.86%)

Molar Mass: 407.283

Atom Count: 45

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	406.069219
Formal Charge	0
FSP3	0.32
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	TXBLBCFAFVSLPX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	99.89
Topological Polar Surface Area	32.78
Polarizability	37.75
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H20BrFN2O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00