N-[4-(cyanomethyl)phenyl]-2-[N-(4-methylphenyl)-3,4-dimethoxybenzenesulfonamido]acetamide

N-[4-(cyanomethyl)phenyl]-2-[N-(4-methylphenyl)-3,4-dimethoxybenzenesulfonamido]acetamide

Formula: C25H25N3O5S

SMILES: COC1=CC=C(C=C1OC)S(=O)(=O)N(CC(=O)NC1=CC=C(CC#N)C=C1)C1=CC=C(C)C=C1

IUPAC: N-[4-(cyanomethyl)phenyl]-2-[N-(4-methylphenyl)-3,4-dimethoxybenzenesulfonamido]acetamide

InChI: InChI=1S/C25H25N3O5S/c1-18-4-10-21(11-5-18)28(17-25(29)27-20-8-6-19(7-9-20)14-15-26)34(30,31)22-12-13-23(32-2)24(16-22)33-3/h4-13,16H,14,17H2,1-3H3,(H,27,29)

Composition: C (62.62%), H (5.25%), N (8.76%), O (16.68%), S (6.69%)

Molar Mass: 479.55

Atom Count: 59

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	479.151492091
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	QLOJWVNAVZHMMZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	130.4
Topological Polar Surface Area	108.73
Polarizability	50
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H25N3O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00