1-[(3-bromophenyl)methyl]-4-(furan-2-carbonyl)piperazine

1-[(3-bromophenyl)methyl]-4-(furan-2-carbonyl)piperazine

Formula: C16H17BrN2O2

SMILES: BrC1=CC=CC(CN2CCN(CC2)C(=O)C2=CC=CO2)=C1

IUPAC: 1-[(3-bromophenyl)methyl]-4-(furan-2-carbonyl)piperazine

InChI: InChI=1S/C16H17BrN2O2/c17-14-4-1-3-13(11-14)12-18-6-8-19(9-7-18)16(20)15-5-2-10-21-15/h1-5,10-11H,6-9,12H2

Composition: C (55.03%), H (4.91%), Br (22.88%), N (8.02%), O (9.16%)

Molar Mass: 349.228

Atom Count: 38

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	348.047341
Formal Charge	0
FSP3	0.31
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	PYZZMAKGJFOWLT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	85.61
Topological Polar Surface Area	36.69
Polarizability	32.41
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H17BrN2O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00