(2E)-N-[(1,3-benzoxazol-2-ylimino)[(2E)-3-(4-methoxyphenyl)prop-2-enamido]methyl]-3-(4-methoxyphenyl)prop-2-enamide

(2E)-N-[(1,3-benzoxazol-2-ylimino)[(2E)-3-(4-methoxyphenyl)prop-2-enamido]methyl]-3-(4-methoxyphenyl)prop-2-enamide

Formula: C28H24N4O5

SMILES: COC1=CC=C(C=CC(=O)NC(NC(=O)C=CC2=CC=C(OC)C=C2)=NC2=NC3=CC=CC=C3O2)C=C1

IUPAC: (2E)-N-{[(1,3-benzoxazol-2-yl)imino][(2E)-3-(4-methoxyphenyl)prop-2-enamido]methyl}-3-(4-methoxyphenyl)prop-2-enamide

InChI: InChI=1S/C28H24N4O5/c1-35-21-13-7-19(8-14-21)11-17-25(33)30-27(32-28-29-23-5-3-4-6-24(23)37-28)31-26(34)18-12-20-9-15-22(36-2)16-10-20/h3-18H,1-2H3,(H2,29,30,31,32,33,34)/b17-11+,18-12+

Composition: C (67.73%), H (4.87%), N (11.28%), O (16.11%)

Molar Mass: 496.523

Atom Count: 61

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	496.174669889
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	IGFIELRQHRXRLB-JYFOCSDGSA-N
Lipinski's Rule of Five
Molar Refractivity	140.92
Topological Polar Surface Area	115.05
Polarizability	53.58
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H24N4O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00