4-acetamido-N-[4-(4-methylpiperidin-1-ylsulfonyl)phenyl]benzamide

4-acetamido-N-[4-(4-methylpiperidin-1-ylsulfonyl)phenyl]benzamide

Formula: C21H25N3O4S

SMILES: CC1CCN(CC1)S(=O)(=O)C1=CC=C(NC(=O)C2=CC=C(NC(C)=O)C=C2)C=C1

IUPAC: 4-acetamido-N-{4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}benzamide

InChI: InChI=1S/C21H25N3O4S/c1-15-11-13-24(14-12-15)29(27,28)20-9-7-19(8-10-20)23-21(26)17-3-5-18(6-4-17)22-16(2)25/h3-10,15H,11-14H2,1-2H3,(H,22,25)(H,23,26)

Composition: C (60.70%), H (6.06%), N (10.11%), O (15.40%), S (7.72%)

Molar Mass: 415.51

Atom Count: 54

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	415.156577471
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	QVJKJRWDMTWRTQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	115.1
Topological Polar Surface Area	95.58
Polarizability	43.43
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H25N3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00