N-({N'-[(E)-2H-1,3-benzodioxol-5-ylmethylidene]hydrazinecarbonyl}methyl)-N-[4-chloro-3-(trifluoromethyl)phenyl]benzenesulfonamide

N-({N'-[(E)-2H-1,3-benzodioxol-5-ylmethylidene]hydrazinecarbonyl}methyl)-N-[4-chloro-3-(trifluoromethyl)phenyl]benzenesulfonamide

Formula: C23H17ClF3N3O5S

SMILES: FC(F)(F)C1=CC(=CC=C1Cl)N(CC(=O)NN=CC1=CC=C2OCOC2=C1)S(=O)(=O)C1=CC=CC=C1

IUPAC: N-({N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}methyl)-N-[4-chloro-3-(trifluoromethyl)phenyl]benzenesulfonamide

InChI: InChI=1S/C23H17ClF3N3O5S/c24-19-8-7-16(11-18(19)23(25,26)27)30(36(32,33)17-4-2-1-3-5-17)13-22(31)29-28-12-15-6-9-20-21(10-15)35-14-34-20/h1-12H,13-14H2,(H,29,31)/b28-12+

Composition: C (51.17%), H (3.17%), Cl (6.57%), F (10.56%), N (7.78%), O (14.82%), S (5.94%)

Molar Mass: 539.91

Atom Count: 53

Heavy Atom Count: 36

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	539.052954
Formal Charge	0
FSP3	0.13
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	WYJNKWNQJDMMMJ-KVSWJAHQSA-N
Lipinski's Rule of Five
Molar Refractivity	125.34
Topological Polar Surface Area	97.3
Polarizability	47.85
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H17ClF3N3O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00