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

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

Formula: C19H18Cl2N2O3

SMILES: ClC1=CC=C(Cl)C(=C1)C(=O)N1CCN(CC2=CC=C3OCOC3=C2)CC1

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

InChI: InChI=1S/C19H18Cl2N2O3/c20-14-2-3-16(21)15(10-14)19(24)23-7-5-22(6-8-23)11-13-1-4-17-18(9-13)26-12-25-17/h1-4,9-10H,5-8,11-12H2

Composition: C (58.03%), H (4.61%), Cl (18.03%), N (7.12%), O (12.20%)

Molar Mass: 393.26

Atom Count: 44

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	392.0694478
Formal Charge	0
FSP3	0.32
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	DZFKWDIISCWDRG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.97
Topological Polar Surface Area	42.01
Polarizability	39.02
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H18Cl2N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00