2-{4-[(E)-{[(3-hydroxy-4-iodophenyl)formamido]imino}methyl]phenoxy}propanoic acid

2-{4-[(E)-{[(3-hydroxy-4-iodophenyl)formamido]imino}methyl]phenoxy}propanoic acid

Formula: C17H15IN2O5

SMILES: CC(OC1=CC=C(C=NNC(=O)C2=CC=C(I)C(O)=C2)C=C1)C(O)=O

IUPAC: 2-{4-[(E)-{[(3-hydroxy-4-iodophenyl)formamido]imino}methyl]phenoxy}propanoic acid

InChI: InChI=1/C17H15IN2O5/c1-10(17(23)24)25-13-5-2-11(3-6-13)9-19-20-16(22)12-4-7-14(18)15(21)8-12/h2-10,21H,1H3,(H,20,22)(H,23,24)/b19-9+

Composition: C (44.95%), H (3.33%), I (27.94%), N (6.17%), O (17.61%)

Molar Mass: 454.22

Atom Count: 40

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	454.00257
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
InChIKey	IOFXOOVCSMUBBF-DJKKODMXNA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.62
Topological Polar Surface Area	108.22
Polarizability	37.94
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H15IN2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00