(5E)-5-{[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

(5E)-5-{[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

Formula: C18H12N2O6S

SMILES: COC1=C(C=C(C=C1)[N+]([O-])=O)C1=CC=C(O1)C=C1SC(=O)N(CC#C)C1=O

IUPAC: (5E)-5-{[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

InChI: InChI=1S/C18H12N2O6S/c1-3-8-19-17(21)16(27-18(19)22)10-12-5-7-15(26-12)13-9-11(20(23)24)4-6-14(13)25-2/h1,4-7,9-10H,8H2,2H3/b16-10+

Composition: C (56.25%), H (3.15%), N (7.29%), O (24.97%), S (8.34%)

Molar Mass: 384.36

Atom Count: 39

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	384.041607288
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	LYYZWFPXEADCLH-MHWRWJLKSA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.89
Topological Polar Surface Area	102.89
Polarizability	37.8
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H12N2O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00