N-(2-{[(4-chlorophenyl)methyl]sulfanyl}ethyl)-2-[N-(2,3-dimethylphenyl)benzenesulfonamido]acetamide

N-(2-{[(4-chlorophenyl)methyl]sulfanyl}ethyl)-2-[N-(2,3-dimethylphenyl)benzenesulfonamido]acetamide

Formula: C25H27ClN2O3S2

SMILES: CC1=C(C)C(=CC=C1)N(CC(=O)NCCSCC1=CC=C(Cl)C=C1)S(=O)(=O)C1=CC=CC=C1

IUPAC: N-(2-{[(4-chlorophenyl)methyl]sulfanyl}ethyl)-2-[N-(2,3-dimethylphenyl)benzenesulfonamido]acetamide

InChI: InChI=1S/C25H27ClN2O3S2/c1-19-7-6-10-24(20(19)2)28(33(30,31)23-8-4-3-5-9-23)17-25(29)27-15-16-32-18-21-11-13-22(26)14-12-21/h3-14H,15-18H2,1-2H3,(H,27,29)

Composition: C (59.69%), H (5.41%), Cl (7.05%), N (5.57%), O (9.54%), S (12.75%)

Molar Mass: 503.07

Atom Count: 60

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	502.1151628
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XTXVXSWWKDMOOA-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	137.27
Topological Polar Surface Area	66.48
Polarizability	53.65
Ring Count	3
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H27ClN2O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00