ethyl 4-(4-acetylpiperazin-1-yl)-3-(3-chloro-4-methoxybenzamido)benzoate

ethyl 4-(4-acetylpiperazin-1-yl)-3-(3-chloro-4-methoxybenzamido)benzoate

Formula: C23H26ClN3O5

SMILES: CCOC(=O)C1=CC=C(N2CCN(CC2)C(C)=O)C(NC(=O)C2=CC=C(OC)C(Cl)=C2)=C1

IUPAC: ethyl 4-(4-acetylpiperazin-1-yl)-3-(3-chloro-4-methoxybenzamido)benzoate

InChI: InChI=1S/C23H26ClN3O5/c1-4-32-23(30)17-5-7-20(27-11-9-26(10-12-27)15(2)28)19(14-17)25-22(29)16-6-8-21(31-3)18(24)13-16/h5-8,13-14H,4,9-12H2,1-3H3,(H,25,29)

Composition: C (60.06%), H (5.70%), Cl (7.71%), N (9.14%), O (17.39%)

Molar Mass: 459.93

Atom Count: 58

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	459.1560986
Formal Charge	0
FSP3	0.35
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	BAUGJBGUEQHAQO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	124.38
Topological Polar Surface Area	88.18
Polarizability	46.34
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H26ClN3O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00