2-[3-(4-nitrobenzoyloxy)phenyl]-1,3-thiazolidine-4-carboxylic acid

2-[3-(4-nitrobenzoyloxy)phenyl]-1,3-thiazolidine-4-carboxylic acid

Formula: C17H14N2O6S

SMILES: OC(=O)C1CSC(N1)C1=CC=CC(OC(=O)C2=CC=C(C=C2)[N+]([O-])=O)=C1

IUPAC: 2-[3-(4-nitrobenzoyloxy)phenyl]-1,3-thiazolidine-4-carboxylic acid

InChI: InChI=1/C17H14N2O6S/c20-16(21)14-9-26-15(18-14)11-2-1-3-13(8-11)25-17(22)10-4-6-12(7-5-10)19(23)24/h1-8,14-15,18H,9H2,(H,20,21)

Composition: C (54.54%), H (3.77%), N (7.48%), O (25.64%), S (8.56%)

Molar Mass: 374.37

Atom Count: 40

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	374.057257353
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	OGMCAQIDQQEMFC-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.39
Topological Polar Surface Area	118.77
Polarizability	36.17
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H14N2O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00