2-methyl-3-nitro-N-{2-[(2-phenylquinolin-4-yl)formamido]ethyl}benzamide

2-methyl-3-nitro-N-{2-[(2-phenylquinolin-4-yl)formamido]ethyl}benzamide

Formula: C26H22N4O4

SMILES: CC1=C(C=CC=C1C(=O)NCCNC(=O)C1=CC(=NC2=CC=CC=C12)C1=CC=CC=C1)[N+]([O-])=O

IUPAC: 2-methyl-3-nitro-N-{2-[(2-phenylquinolin-4-yl)formamido]ethyl}benzamide

InChI: InChI=1S/C26H22N4O4/c1-17-19(11-7-13-24(17)30(33)34)25(31)27-14-15-28-26(32)21-16-23(18-8-3-2-4-9-18)29-22-12-6-5-10-20(21)22/h2-13,16H,14-15H2,1H3,(H,27,31)(H,28,32)

Composition: C (68.71%), H (4.88%), N (12.33%), O (14.08%)

Molar Mass: 454.486

Atom Count: 56

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	454.164105204
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	BLHGKAJHCZQGFG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	128.14
Topological Polar Surface Area	114.23
Polarizability	50.46
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H22N4O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00