5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Formula: C13H12N2O3S

SMILES: CN1C(=S)N(C)C(=O)C(=CC=CC2=CC=CO2)C1=O

IUPAC: 5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

InChI: InChI=1S/C13H12N2O3S/c1-14-11(16)10(12(17)15(2)13(14)19)7-3-5-9-6-4-8-18-9/h3-8H,1-2H3/b5-3+

Composition: C (56.51%), H (4.38%), N (10.14%), O (17.37%), S (11.60%)

Molar Mass: 276.31

Atom Count: 31

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	276.056863428
Formal Charge	0
FSP3	0.15
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	HVHREFYGNJFKOQ-HWKANZROSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.62
Topological Polar Surface Area	53.76
Polarizability	28.43
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H12N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00