1-(2H-1,3-benzodioxol-5-ylmethyl)-4-(2-chlorobenzoyl)piperazine

1-(2H-1,3-benzodioxol-5-ylmethyl)-4-(2-chlorobenzoyl)piperazine

Formula: C19H19ClN2O3

SMILES: ClC1=CC=CC=C1C(=O)N1CCN(CC2=CC=C3OCOC3=C2)CC1

IUPAC: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(2-chlorobenzoyl)piperazine

InChI: InChI=1S/C19H19ClN2O3/c20-16-4-2-1-3-15(16)19(23)22-9-7-21(8-10-22)12-14-5-6-17-18(11-14)25-13-24-17/h1-6,11H,7-10,12-13H2

Composition: C (63.60%), H (5.34%), Cl (9.88%), N (7.81%), O (13.38%)

Molar Mass: 358.82

Atom Count: 44

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	358.1084202
Formal Charge	0
FSP3	0.32
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	XBTMLTKISVDMIY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.16
Topological Polar Surface Area	42.01
Polarizability	37.12
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H19ClN2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00