N-[2-(tert-butylsulfanyl)ethyl]-2-[N-(5-chloro-2-methylphenyl)methanesulfonamido]acetamide

N-[2-(tert-butylsulfanyl)ethyl]-2-[N-(5-chloro-2-methylphenyl)methanesulfonamido]acetamide

Formula: C16H25ClN2O3S2

SMILES: CC1=CC=C(Cl)C=C1N(CC(=O)NCCSC(C)(C)C)S(C)(=O)=O

IUPAC: N-[2-(tert-butylsulfanyl)ethyl]-2-[N-(5-chloro-2-methylphenyl)methanesulfonamido]acetamide

InChI: InChI=1S/C16H25ClN2O3S2/c1-12-6-7-13(17)10-14(12)19(24(5,21)22)11-15(20)18-8-9-23-16(2,3)4/h6-7,10H,8-9,11H2,1-5H3,(H,18,20)

Composition: C (48.91%), H (6.41%), Cl (9.02%), N (7.13%), O (12.21%), S (16.32%)

Molar Mass: 392.96

Atom Count: 49

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	392.0995127
Formal Charge	0
FSP3	0.56
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	SHPPQYXPUUHJND-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	101.37
Topological Polar Surface Area	66.48
Polarizability	40.15
Ring Count	1
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H25ClN2O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00