3-nitro-4-(piperidin-1-yl)-N-[3-(thiophen-2-ylformamido)propyl]benzamide

3-nitro-4-(piperidin-1-yl)-N-[3-(thiophen-2-ylformamido)propyl]benzamide

Formula: C20H24N4O4S

SMILES: [O-][N+](=O)C1=CC(=CC=C1N1CCCCC1)C(=O)NCCCNC(=O)C1=CC=CS1

IUPAC: 3-nitro-4-(piperidin-1-yl)-N-{3-[(thiophen-2-yl)formamido]propyl}benzamide

InChI: InChI=1S/C20H24N4O4S/c25-19(21-9-5-10-22-20(26)18-6-4-13-29-18)15-7-8-16(17(14-15)24(27)28)23-11-2-1-3-12-23/h4,6-8,13-14H,1-3,5,9-12H2,(H,21,25)(H,22,26)

Composition: C (57.68%), H (5.81%), N (13.45%), O (15.37%), S (7.70%)

Molar Mass: 416.5

Atom Count: 53

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	416.151826443
Formal Charge	0
FSP3	0.4
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	UVKUCPROYCQUGE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	112.74
Topological Polar Surface Area	104.58
Polarizability	41.35
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H24N4O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00