N-[4-(cyanomethyl)phenyl]-4-(N-methyl-4-methoxybenzenesulfonamido)benzamide

N-[4-(cyanomethyl)phenyl]-4-(N-methyl-4-methoxybenzenesulfonamido)benzamide

Formula: C23H21N3O4S

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

IUPAC: N-[4-(cyanomethyl)phenyl]-4-(N-methyl-4-methoxybenzenesulfonamido)benzamide

InChI: InChI=1S/C23H21N3O4S/c1-26(31(28,29)22-13-11-21(30-2)12-14-22)20-9-5-18(6-10-20)23(27)25-19-7-3-17(4-8-19)15-16-24/h3-14H,15H2,1-2H3,(H,25,27)

Composition: C (63.43%), H (4.86%), N (9.65%), O (14.69%), S (7.36%)

Molar Mass: 435.5

Atom Count: 52

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	435.125277342
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	ALPIQPBIOLBBTR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	120.07
Topological Polar Surface Area	99.5
Polarizability	45.68
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H21N3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00