1-(2-nitrobenzenesulfonyl)-4-(1-propylpiperidin-4-yl)piperazine

1-(2-nitrobenzenesulfonyl)-4-(1-propylpiperidin-4-yl)piperazine

Formula: C18H28N4O4S

SMILES: CCCN1CCC(CC1)N1CCN(CC1)S(=O)(=O)C1=CC=CC=C1[N+]([O-])=O

IUPAC: 1-(2-nitrobenzenesulfonyl)-4-(1-propylpiperidin-4-yl)piperazine

InChI: InChI=1S/C18H28N4O4S/c1-2-9-19-10-7-16(8-11-19)20-12-14-21(15-13-20)27(25,26)18-6-4-3-5-17(18)22(23)24/h3-6,16H,2,7-15H2,1H3

Composition: C (54.53%), H (7.12%), N (14.13%), O (16.14%), S (8.09%)

Molar Mass: 396.51

Atom Count: 55

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	396.183126572
Formal Charge	0
FSP3	0.67
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	PAHGRYFQGLQOQN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	105.1
Topological Polar Surface Area	87
Polarizability	41.19
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H28N4O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00