methyl 4-(4-benzoylpiperazin-1-yl)-3-(4-nitrobenzamido)benzoate

methyl 4-(4-benzoylpiperazin-1-yl)-3-(4-nitrobenzamido)benzoate

Formula: C26H24N4O6

SMILES: COC(=O)C1=CC=C(N2CCN(CC2)C(=O)C2=CC=CC=C2)C(NC(=O)C2=CC=C(C=C2)[N+]([O-])=O)=C1

IUPAC: methyl 4-(4-benzoylpiperazin-1-yl)-3-(4-nitrobenzamido)benzoate

InChI: InChI=1S/C26H24N4O6/c1-36-26(33)20-9-12-23(22(17-20)27-24(31)18-7-10-21(11-8-18)30(34)35)28-13-15-29(16-14-28)25(32)19-5-3-2-4-6-19/h2-12,17H,13-16H2,1H3,(H,27,31)

Composition: C (63.93%), H (4.95%), N (11.47%), O (19.65%)

Molar Mass: 488.5

Atom Count: 60

Heavy Atom Count: 36

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	488.169584509
Formal Charge	0
FSP3	0.19
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	WHTLUXFCRHGVTQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	135.36
Topological Polar Surface Area	122.09
Polarizability	49.47
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H24N4O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00