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

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

Formula: C18H20N2O4S

SMILES: O=S(=O)(N1CCN(CC2=CC=C3OCOC3=C2)CC1)C1=CC=CC=C1

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

InChI: InChI=1S/C18H20N2O4S/c21-25(22,16-4-2-1-3-5-16)20-10-8-19(9-11-20)13-15-6-7-17-18(12-15)24-14-23-17/h1-7,12H,8-11,13-14H2

Composition: C (59.98%), H (5.59%), N (7.77%), O (17.76%), S (8.89%)

Molar Mass: 360.43

Atom Count: 45

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	360.114378306
Formal Charge	0
FSP3	0.33
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	OEMVHNGCXFDGTI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	94.44
Topological Polar Surface Area	59.08
Polarizability	37.67
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H20N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00