4-chloro-3-{5-[(E)-{[(4-methoxyphenyl)formamido]imino}methyl]furan-2-yl}benzoic acid

4-chloro-3-{5-[(E)-{[(4-methoxyphenyl)formamido]imino}methyl]furan-2-yl}benzoic acid

Formula: C20H15ClN2O5

SMILES: COC1=CC=C(C=C1)C(=O)NN=CC1=CC=C(O1)C1=CC(=CC=C1Cl)C(O)=O

IUPAC: 4-chloro-3-{5-[(E)-{[(4-methoxyphenyl)formamido]imino}methyl]furan-2-yl}benzoic acid

InChI: InChI=1S/C20H15ClN2O5/c1-27-14-5-2-12(3-6-14)19(24)23-22-11-15-7-9-18(28-15)16-10-13(20(25)26)4-8-17(16)21/h2-11H,1H3,(H,23,24)(H,25,26)/b22-11+

Composition: C (60.24%), H (3.79%), Cl (8.89%), N (7.02%), O (20.06%)

Molar Mass: 398.8

Atom Count: 43

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	398.0669493
Formal Charge	0
FSP3	0.05
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	WRQUOMKLKQQNQF-SSDVNMTOSA-N
Lipinski's Rule of Five	1
Molar Refractivity	104.16
Topological Polar Surface Area	101.13
Polarizability	39.9
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H15ClN2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00