1-[(3-bromophenyl)methyl]-4-(3,5-dimethoxybenzoyl)piperazine

1-[(3-bromophenyl)methyl]-4-(3,5-dimethoxybenzoyl)piperazine

Formula: C20H23BrN2O3

SMILES: COC1=CC(=CC(OC)=C1)C(=O)N1CCN(CC2=CC=CC(Br)=C2)CC1

IUPAC: 1-[(3-bromophenyl)methyl]-4-(3,5-dimethoxybenzoyl)piperazine

InChI: InChI=1S/C20H23BrN2O3/c1-25-18-11-16(12-19(13-18)26-2)20(24)23-8-6-22(7-9-23)14-15-4-3-5-17(21)10-15/h3-5,10-13H,6-9,14H2,1-2H3

Composition: C (57.29%), H (5.53%), Br (19.06%), N (6.68%), O (11.45%)

Molar Mass: 419.319

Atom Count: 49

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	418.089206
Formal Charge	0
FSP3	0.35
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	SACCPERDIALFMV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	106.14
Topological Polar Surface Area	42.01
Polarizability	40.54
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H23BrN2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00