2-[(E)-({2-[5-(furan-2-amido)-1,3,4-thiadiazol-2-yl]acetamido}imino)methyl]phenyl benzenesulfonate

2-[(E)-({2-[5-(furan-2-amido)-1,3,4-thiadiazol-2-yl]acetamido}imino)methyl]phenyl benzenesulfonate

Formula: C22H17N5O6S2

SMILES: O=C(CC1=NN=C(NC(=O)C2=CC=CO2)S1)NN=CC1=CC=CC=C1OS(=O)(=O)C1=CC=CC=C1

IUPAC: 2-[(E)-({2-[5-(furan-2-amido)-1,3,4-thiadiazol-2-yl]acetamido}imino)methyl]phenyl benzenesulfonate

InChI: InChI=1S/C22H17N5O6S2/c28-19(13-20-26-27-22(34-20)24-21(29)18-11-6-12-32-18)25-23-14-15-7-4-5-10-17(15)33-35(30,31)16-8-2-1-3-9-16/h1-12,14H,13H2,(H,25,28)(H,24,27,29)/b23-14+

Composition: C (51.66%), H (3.35%), N (13.69%), O (18.77%), S (12.54%)

Molar Mass: 511.53

Atom Count: 52

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	511.062025635
Formal Charge	0
FSP3	0.05
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
InChIKey	SOWBTXBDPCFVHB-OEAKJJBVSA-N
Lipinski's Rule of Five
Molar Refractivity	129.38
Topological Polar Surface Area	152.85
Polarizability	48.35
Ring Count	4
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H17N5O6S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00