3-{[(furan-2-yl)methyl]amino}-1??,2-benzothiazole-1,1-dione

3-{[(furan-2-yl)methyl]amino}-1??,2-benzothiazole-1,1-dione

Formula: C12H10N2O3S

SMILES: O=S1(=O)N=C(NCC2=CC=CO2)C2=C1C=CC=C2

IUPAC: 3-{[(furan-2-yl)methyl]amino}-1??,2-benzothiazole-1,1-dione

InChI: InChI=1S/C12H10N2O3S/c15-18(16)11-6-2-1-5-10(11)12(14-18)13-8-9-4-3-7-17-9/h1-7H,8H2,(H,13,14)

Composition: C (54.95%), H (3.84%), N (10.68%), O (18.30%), S (12.22%)

Molar Mass: 262.28

Atom Count: 28

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	262.041213364
Formal Charge	0
FSP3	0.08
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	QLESNUQMKFIQBU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.15
Topological Polar Surface Area	71.67
Polarizability	25.77
Ring Count	3
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H10N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00