methyl 4-(4-benzylpiperazin-1-yl)-3-(3-methoxynaphthalene-2-amido)benzoate

methyl 4-(4-benzylpiperazin-1-yl)-3-(3-methoxynaphthalene-2-amido)benzoate

Formula: C31H31N3O4

SMILES: COC(=O)C1=CC=C(N2CCN(CC3=CC=CC=C3)CC2)C(NC(=O)C2=CC3=CC=CC=C3C=C2OC)=C1

IUPAC: methyl 4-(4-benzylpiperazin-1-yl)-3-(3-methoxynaphthalene-2-amido)benzoate

InChI: InChI=1S/C31H31N3O4/c1-37-29-20-24-11-7-6-10-23(24)18-26(29)30(35)32-27-19-25(31(36)38-2)12-13-28(27)34-16-14-33(15-17-34)21-22-8-4-3-5-9-22/h3-13,18-20H,14-17,21H2,1-2H3,(H,32,35)

Composition: C (73.06%), H (6.13%), N (8.25%), O (12.56%)

Molar Mass: 509.606

Atom Count: 69

Heavy Atom Count: 38

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	509.23145649
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	FGZTYYNDJVABEF-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	151.62
Topological Polar Surface Area	71.11
Polarizability	58.14
Ring Count	5
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C31H31N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00