2-(2-imino-4-oxo-1,3-thiazolidin-5-yl)-N-(4-methoxy-2-nitrophenyl)acetamide

2-(2-imino-4-oxo-1,3-thiazolidin-5-yl)-N-(4-methoxy-2-nitrophenyl)acetamide

Formula: C12H12N4O5S

SMILES: COC1=CC=C(NC(=O)CC2SC(=N)NC2=O)C(=C1)[N+]([O-])=O

IUPAC: 2-(2-imino-4-oxo-1,3-thiazolidin-5-yl)-N-(4-methoxy-2-nitrophenyl)acetamide

InChI: InChI=1/C12H12N4O5S/c1-21-6-2-3-7(8(4-6)16(19)20)14-10(17)5-9-11(18)15-12(13)22-9/h2-4,9H,5H2,1H3,(H,14,17)(H2,13,15,18)

Composition: C (44.44%), H (3.73%), N (17.28%), O (24.67%), S (9.89%)

Molar Mass: 324.31

Atom Count: 34

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	324.052840676
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
InChIKey	KJVRXZNLRKEHCT-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	89.6
Topological Polar Surface Area	134.42
Polarizability	29.61
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H12N4O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00