(2Z)-2-(4-chloro-2-fluorobenzenesulfonyl)-3-(dimethylamino)-1-(4-methylpiperidin-1-yl)prop-2-en-1-one

(2Z)-2-(4-chloro-2-fluorobenzenesulfonyl)-3-(dimethylamino)-1-(4-methylpiperidin-1-yl)prop-2-en-1-one

Formula: C17H22ClFN2O3S

SMILES: CC1CCN(CC1)C(=O)C(=CN(C)C)S(=O)(=O)C1=CC=C(Cl)C=C1F

IUPAC: (2Z)-2-(4-chloro-2-fluorobenzenesulfonyl)-3-(dimethylamino)-1-(4-methylpiperidin-1-yl)prop-2-en-1-one

InChI: InChI=1S/C17H22ClFN2O3S/c1-12-6-8-21(9-7-12)17(22)16(11-20(2)3)25(23,24)15-5-4-13(18)10-14(15)19/h4-5,10-12H,6-9H2,1-3H3/b16-11-

Composition: C (52.51%), H (5.70%), Cl (9.12%), F (4.89%), N (7.20%), O (12.34%), S (8.24%)

Molar Mass: 388.88

Atom Count: 47

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	388.1023696
Formal Charge	0
FSP3	0.47
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	AESVDMUJFBLEML-WJDWOHSUSA-N
Lipinski's Rule of Five	1
Molar Refractivity	97.84
Topological Polar Surface Area	57.69
Polarizability	37.74
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H22ClFN2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00