2-[(2-chlorophenyl)(1,1-dioxo-1??,2-benzothiazol-3-yl)amino]ethyl 2-fluorobenzoate

2-[(2-chlorophenyl)(1,1-dioxo-1??,2-benzothiazol-3-yl)amino]ethyl 2-fluorobenzoate

Formula: C22H16ClFN2O4S

SMILES: FC1=CC=CC=C1C(=O)OCCN(C1=NS(=O)(=O)C2=C1C=CC=C2)C1=CC=CC=C1Cl

IUPAC: 2-[(2-chlorophenyl)(1,1-dioxo-1??,2-benzothiazol-3-yl)amino]ethyl 2-fluorobenzoate

InChI: InChI=1S/C22H16ClFN2O4S/c23-17-9-3-5-11-19(17)26(13-14-30-22(27)15-7-1-4-10-18(15)24)21-16-8-2-6-12-20(16)31(28,29)25-21/h1-12H,13-14H2

Composition: C (57.58%), H (3.51%), Cl (7.73%), F (4.14%), N (6.10%), O (13.95%), S (6.99%)

Molar Mass: 458.89

Atom Count: 47

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	458.050334
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	KNMWLLOMKWBHHP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	116.08
Topological Polar Surface Area	76.04
Polarizability	44.49
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H16ClFN2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00