N'-[(2E)-5,5-bis(hydroxymethyl)-4-oxo-1,3-thiazolidin-2-ylidene]benzohydrazide

N'-[(2E)-5,5-bis(hydroxymethyl)-4-oxo-1,3-thiazolidin-2-ylidene]benzohydrazide

Formula: C12H13N3O4S

SMILES: OCC1(CO)SC(NC1=O)=NNC(=O)C1=CC=CC=C1

IUPAC: N'-[(2E)-5,5-bis(hydroxymethyl)-4-oxo-1,3-thiazolidin-2-ylidene]benzohydrazide

InChI: InChI=1S/C12H13N3O4S/c16-6-12(7-17)10(19)13-11(20-12)15-14-9(18)8-4-2-1-3-5-8/h1-5,16-17H,6-7H2,(H,14,18)(H,13,15,19)

Composition: C (48.81%), H (4.44%), N (14.23%), O (21.67%), S (10.86%)

Molar Mass: 295.31

Atom Count: 33

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	295.062677085
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	4
InChIKey	JANIXOSVHNHLTG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.43
Topological Polar Surface Area	111.02
Polarizability	28.03
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H13N3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00