ethyl 4-(4-benzoylpiperazin-1-yl)-3-(2-methylbenzamido)benzoate

ethyl 4-(4-benzoylpiperazin-1-yl)-3-(2-methylbenzamido)benzoate

Formula: C28H29N3O4

SMILES: CCOC(=O)C1=CC=C(N2CCN(CC2)C(=O)C2=CC=CC=C2)C(NC(=O)C2=CC=CC=C2C)=C1

IUPAC: ethyl 4-(4-benzoylpiperazin-1-yl)-3-(2-methylbenzamido)benzoate

InChI: InChI=1S/C28H29N3O4/c1-3-35-28(34)22-13-14-25(24(19-22)29-26(32)23-12-8-7-9-20(23)2)30-15-17-31(18-16-30)27(33)21-10-5-4-6-11-21/h4-14,19H,3,15-18H2,1-2H3,(H,29,32)

Composition: C (71.32%), H (6.20%), N (8.91%), O (13.57%)

Molar Mass: 471.557

Atom Count: 64

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	471.215806426
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	IPSPYBRXZLQCJN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	138.83
Topological Polar Surface Area	78.95
Polarizability	51.16
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H29N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00