N-(2,5-dimethoxyphenyl)-1-(4-methylbenzenesulfonyl)piperidine-4-carboxamide

N-(2,5-dimethoxyphenyl)-1-(4-methylbenzenesulfonyl)piperidine-4-carboxamide

Formula: C21H26N2O5S

SMILES: COC1=CC=C(OC)C(NC(=O)C2CCN(CC2)S(=O)(=O)C2=CC=C(C)C=C2)=C1

IUPAC: N-(2,5-dimethoxyphenyl)-1-(4-methylbenzenesulfonyl)piperidine-4-carboxamide

InChI: InChI=1S/C21H26N2O5S/c1-15-4-7-18(8-5-15)29(25,26)23-12-10-16(11-13-23)21(24)22-19-14-17(27-2)6-9-20(19)28-3/h4-9,14,16H,10-13H2,1-3H3,(H,22,24)

Composition: C (60.27%), H (6.26%), N (6.69%), O (19.11%), S (7.66%)

Molar Mass: 418.51

Atom Count: 55

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	418.156243119
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	XWOUUVLVUYHFON-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	112.64
Topological Polar Surface Area	84.94
Polarizability	43.54
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H26N2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00