N-(2-{[(2,4-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(N-phenylmethanesulfonamido)propanamide

N-(2-{[(2,4-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(N-phenylmethanesulfonamido)propanamide

Formula: C19H22Cl2N2O3S2

SMILES: CC(N(C1=CC=CC=C1)S(C)(=O)=O)C(=O)NCCSCC1=CC=C(Cl)C=C1Cl

IUPAC: N-(2-{[(2,4-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(N-phenylmethanesulfonamido)propanamide

InChI: InChI=1/C19H22Cl2N2O3S2/c1-14(23(28(2,25)26)17-6-4-3-5-7-17)19(24)22-10-11-27-13-15-8-9-16(20)12-18(15)21/h3-9,12,14H,10-11,13H2,1-2H3,(H,22,24)

Composition: C (49.46%), H (4.81%), Cl (15.37%), N (6.07%), O (10.40%), S (13.90%)

Molar Mass: 461.42

Atom Count: 50

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	460.0448903
Formal Charge	0
FSP3	0.32
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	TVQMCLOZJWFLBU-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	116.33
Topological Polar Surface Area	66.48
Polarizability	46.18
Ring Count	2
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H22Cl2N2O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00