N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}methanesulfonamide

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}methanesulfonamide

Formula: C21H24FN3O5S

SMILES: CS(=O)(=O)N(CC(=O)N1CCN(CC1)C1=CC=CC=C1F)C1=CC=C2OCCOC2=C1

IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}methanesulfonamide

InChI: InChI=1S/C21H24FN3O5S/c1-31(27,28)25(16-6-7-19-20(14-16)30-13-12-29-19)15-21(26)24-10-8-23(9-11-24)18-5-3-2-4-17(18)22/h2-7,14H,8-13,15H2,1H3

Composition: C (56.11%), H (5.38%), F (4.23%), N (9.35%), O (17.80%), S (7.13%)

Molar Mass: 449.5

Atom Count: 55

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	449.142070222
Formal Charge	0
FSP3	0.38
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	RSQQRBWXLNIFHF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	113.06
Topological Polar Surface Area	79.39
Polarizability	43.82
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H24FN3O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00