ethyl 4-(4-acetylpiperazin-1-yl)-3-(3-bromo-4-ethoxybenzamido)benzoate

ethyl 4-(4-acetylpiperazin-1-yl)-3-(3-bromo-4-ethoxybenzamido)benzoate

Formula: C24H28BrN3O5

SMILES: CCOC(=O)C1=CC=C(N2CCN(CC2)C(C)=O)C(NC(=O)C2=CC=C(OCC)C(Br)=C2)=C1

IUPAC: ethyl 4-(4-acetylpiperazin-1-yl)-3-(3-bromo-4-ethoxybenzamido)benzoate

InChI: InChI=1S/C24H28BrN3O5/c1-4-32-22-9-7-17(14-19(22)25)23(30)26-20-15-18(24(31)33-5-2)6-8-21(20)28-12-10-27(11-13-28)16(3)29/h6-9,14-15H,4-5,10-13H2,1-3H3,(H,26,30)

Composition: C (55.61%), H (5.44%), Br (15.41%), N (8.11%), O (15.43%)

Molar Mass: 518.408

Atom Count: 61

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	517.121234
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	ZXONOLFQEDRWKD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	131.95
Topological Polar Surface Area	88.18
Polarizability	49.07
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H28BrN3O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00