ethyl 5-(3-bromo-4-methoxybenzamido)-2-(morpholin-4-yl)benzoate

ethyl 5-(3-bromo-4-methoxybenzamido)-2-(morpholin-4-yl)benzoate

Formula: C21H23BrN2O5

SMILES: CCOC(=O)C1=CC(NC(=O)C2=CC=C(OC)C(Br)=C2)=CC=C1N1CCOCC1

IUPAC: ethyl 5-(3-bromo-4-methoxybenzamido)-2-(morpholin-4-yl)benzoate

InChI: InChI=1S/C21H23BrN2O5/c1-3-29-21(26)16-13-15(5-6-18(16)24-8-10-28-11-9-24)23-20(25)14-4-7-19(27-2)17(22)12-14/h4-7,12-13H,3,8-11H2,1-2H3,(H,23,25)

Composition: C (54.44%), H (5.00%), Br (17.25%), N (6.05%), O (17.27%)

Molar Mass: 463.328

Atom Count: 52

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	462.079035
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	QYUFEWPQMGCSLC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	115.95
Topological Polar Surface Area	77.1
Polarizability	43.04
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H23BrN2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00