N-[2-(tert-butylsulfanyl)ethyl]-2-[N-(3-chloro-4-methoxyphenyl)-4-methylbenzenesulfonamido]acetamide

N-[2-(tert-butylsulfanyl)ethyl]-2-[N-(3-chloro-4-methoxyphenyl)-4-methylbenzenesulfonamido]acetamide

Formula: C22H29ClN2O4S2

SMILES: COC1=CC=C(C=C1Cl)N(CC(=O)NCCSC(C)(C)C)S(=O)(=O)C1=CC=C(C)C=C1

IUPAC: N-[2-(tert-butylsulfanyl)ethyl]-2-[N-(3-chloro-4-methoxyphenyl)-4-methylbenzenesulfonamido]acetamide

InChI: InChI=1S/C22H29ClN2O4S2/c1-16-6-9-18(10-7-16)31(27,28)25(17-8-11-20(29-5)19(23)14-17)15-21(26)24-12-13-30-22(2,3)4/h6-11,14H,12-13,15H2,1-5H3,(H,24,26)

Composition: C (54.48%), H (6.03%), Cl (7.31%), N (5.78%), O (13.19%), S (13.22%)

Molar Mass: 485.05

Atom Count: 60

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	484.1257275
Formal Charge	0
FSP3	0.41
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	NPCGRHMEYFHMSL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	127.98
Topological Polar Surface Area	75.71
Polarizability	50.39
Ring Count	2
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H29ClN2O4S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00