ethyl 4-{5-[(E)-[(4-methylbenzenesulfonamido)imino]methyl]furan-2-yl}benzoate

ethyl 4-{5-[(E)-[(4-methylbenzenesulfonamido)imino]methyl]furan-2-yl}benzoate

Formula: C21H20N2O5S

SMILES: CCOC(=O)C1=CC=C(C=C1)C1=CC=C(O1)C=NNS(=O)(=O)C1=CC=C(C)C=C1

IUPAC: ethyl 4-{5-[(E)-[(4-methylbenzenesulfonamido)imino]methyl]furan-2-yl}benzoate

InChI: InChI=1S/C21H20N2O5S/c1-3-27-21(24)17-8-6-16(7-9-17)20-13-10-18(28-20)14-22-23-29(25,26)19-11-4-15(2)5-12-19/h4-14,23H,3H2,1-2H3/b22-14+

Composition: C (61.15%), H (4.89%), N (6.79%), O (19.39%), S (7.77%)

Molar Mass: 412.46

Atom Count: 49

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	412.109292926
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ZDTNCAFRWBKPEH-HYARGMPZSA-N
Lipinski's Rule of Five	1
Molar Refractivity	110.53
Topological Polar Surface Area	97.97
Polarizability	43.6
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H20N2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00