2-[N-(2H-1,3-benzodioxol-5-yl)methanesulfonamido]-N-(2H-1,3-benzodioxol-5-ylmethyl)acetamide

2-[N-(2H-1,3-benzodioxol-5-yl)methanesulfonamido]-N-(2H-1,3-benzodioxol-5-ylmethyl)acetamide

Formula: C18H18N2O7S

SMILES: CS(=O)(=O)N(CC(=O)NCC1=CC=C2OCOC2=C1)C1=CC=C2OCOC2=C1

IUPAC: 2-[N-(2H-1,3-benzodioxol-5-yl)methanesulfonamido]-N-[(2H-1,3-benzodioxol-5-yl)methyl]acetamide

InChI: InChI=1S/C18H18N2O7S/c1-28(22,23)20(13-3-5-15-17(7-13)27-11-25-15)9-18(21)19-8-12-2-4-14-16(6-12)26-10-24-14/h2-7H,8-11H2,1H3,(H,19,21)

Composition: C (53.20%), H (4.46%), N (6.89%), O (27.56%), S (7.89%)

Molar Mass: 406.41

Atom Count: 46

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	406.083472102
Formal Charge	0
FSP3	0.28
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	BEQOYGBBWLZRPT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.59
Topological Polar Surface Area	103.4
Polarizability	38.87
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H18N2O7S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00