4-{N-[(4-methylphenyl)methyl]methanesulfonamido}-N-(2-{[(2-methylphenyl)methyl]sulfanyl}ethyl)benzamide

4-{N-[(4-methylphenyl)methyl]methanesulfonamido}-N-(2-{[(2-methylphenyl)methyl]sulfanyl}ethyl)benzamide

Formula: C26H30N2O3S2

SMILES: CC1=CC=C(CN(C2=CC=C(C=C2)C(=O)NCCSCC2=CC=CC=C2C)S(C)(=O)=O)C=C1

IUPAC: 4-{N-[(4-methylphenyl)methyl]methanesulfonamido}-N-(2-{[(2-methylphenyl)methyl]sulfanyl}ethyl)benzamide

InChI: InChI=1S/C26H30N2O3S2/c1-20-8-10-22(11-9-20)18-28(33(3,30)31)25-14-12-23(13-15-25)26(29)27-16-17-32-19-24-7-5-4-6-21(24)2/h4-15H,16-19H2,1-3H3,(H,27,29)

Composition: C (64.70%), H (6.27%), N (5.80%), O (9.94%), S (13.28%)

Molar Mass: 482.66

Atom Count: 63

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	482.169785182
Formal Charge	0
FSP3	0.27
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YCBVHAHMKYKHQC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	138.1
Topological Polar Surface Area	66.48
Polarizability	53.44
Ring Count	3
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H30N2O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00