1-[(5-bromo-2-methoxyphenyl)methyl]-4-(pyridine-4-carbonyl)piperazine

1-[(5-bromo-2-methoxyphenyl)methyl]-4-(pyridine-4-carbonyl)piperazine

Formula: C18H20BrN3O2

SMILES: COC1=CC=C(Br)C=C1CN1CCN(CC1)C(=O)C1=CC=NC=C1

IUPAC: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-(pyridine-4-carbonyl)piperazine

InChI: InChI=1S/C18H20BrN3O2/c1-24-17-3-2-16(19)12-15(17)13-21-8-10-22(11-9-21)18(23)14-4-6-20-7-5-14/h2-7,12H,8-11,13H2,1H3

Composition: C (55.40%), H (5.17%), Br (20.47%), N (10.77%), O (8.20%)

Molar Mass: 390.281

Atom Count: 44

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	389.07389
Formal Charge	0
FSP3	0.33
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	JLHURFAGWWAGBZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	97.52
Topological Polar Surface Area	45.67
Polarizability	37.13
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H20BrN3O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00