ethyl 4-{[(8-hydroxyquinolin-7-yl)(phenyl)methyl]amino}benzoate

ethyl 4-{[(8-hydroxyquinolin-7-yl)(phenyl)methyl]amino}benzoate

Formula: C25H22N2O3

SMILES: CCOC(=O)C1=CC=C(NC(C2=CC=CC=C2)C2=C(O)C3=NC=CC=C3C=C2)C=C1

IUPAC: ethyl 4-{[(8-hydroxyquinolin-7-yl)(phenyl)methyl]amino}benzoate

InChI: InChI=1/C25H22N2O3/c1-2-30-25(29)19-10-13-20(14-11-19)27-22(17-7-4-3-5-8-17)21-15-12-18-9-6-16-26-23(18)24(21)28/h3-16,22,27-28H,2H2,1H3

Composition: C (75.36%), H (5.57%), N (7.03%), O (12.05%)

Molar Mass: 398.462

Atom Count: 52

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	1
Exact Mass	398.163042576
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	OTJPJABPMDRCJV-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	117.82
Topological Polar Surface Area	71.45
Polarizability	46.01
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H22N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00