4-bromo-2-({4-[(4-chlorophenyl)methyl]piperazin-1-yl}methyl)phenol

4-bromo-2-({4-[(4-chlorophenyl)methyl]piperazin-1-yl}methyl)phenol

Formula: C18H20BrClN2O

SMILES: OC1=CC=C(Br)C=C1CN1CCN(CC2=CC=C(Cl)C=C2)CC1

IUPAC: 4-bromo-2-({4-[(4-chlorophenyl)methyl]piperazin-1-yl}methyl)phenol

InChI: InChI=1S/C18H20BrClN2O/c19-16-3-6-18(23)15(11-16)13-22-9-7-21(8-10-22)12-14-1-4-17(20)5-2-14/h1-6,11,23H,7-10,12-13H2

Composition: C (54.63%), H (5.09%), Br (20.19%), Cl (8.96%), N (7.08%), O (4.04%)

Molar Mass: 395.73

Atom Count: 43

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	394.044754
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	UDBUKNAECQQGSK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	99.67
Topological Polar Surface Area	26.71
Polarizability	38.47
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H20BrClN2O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00