5-{5-[(1E)-2-cyano-2-[(2-methoxyphenyl)carbamoyl]eth-1-en-1-yl]furan-2-yl}benzene-1,3-dicarboxylic acid

5-{5-[(1E)-2-cyano-2-[(2-methoxyphenyl)carbamoyl]eth-1-en-1-yl]furan-2-yl}benzene-1,3-dicarboxylic acid

Formula: C23H16N2O7

SMILES: COC1=CC=CC=C1NC(=O)C(=CC1=CC=C(O1)C1=CC(=CC(=C1)C(O)=O)C(O)=O)C#N

IUPAC: 5-{5-[(1E)-2-cyano-2-[(2-methoxyphenyl)carbamoyl]eth-1-en-1-yl]furan-2-yl}benzene-1,3-dicarboxylic acid

InChI: InChI=1S/C23H16N2O7/c1-31-20-5-3-2-4-18(20)25-21(26)16(12-24)11-17-6-7-19(32-17)13-8-14(22(27)28)10-15(9-13)23(29)30/h2-11H,1H3,(H,25,26)(H,27,28)(H,29,30)/b16-11+

Composition: C (63.89%), H (3.73%), N (6.48%), O (25.90%)

Molar Mass: 432.388

Atom Count: 48

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	432.095750863
Formal Charge	0
FSP3	0.04
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
InChIKey	CWJFGGIDHLAFFV-LFIBNONCSA-N
Lipinski's Rule of Five	1
Molar Refractivity	114.77
Topological Polar Surface Area	149.86
Polarizability	43.12
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H16N2O7		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00