9-acetyl-8??-thia-1-azatricyclo[8.4.0.0²,?]tetradeca-2(7),3,5,9-tetraene-8,8-dione

9-acetyl-8??-thia-1-azatricyclo[8.4.0.0²,?]tetradeca-2(7),3,5,9-tetraene-8,8-dione

Formula: C14H15NO3S

SMILES: CC(=O)C1=C2CCCCN2C2=C(C=CC=C2)S1(=O)=O

IUPAC: 9-acetyl-8??-thia-1-azatricyclo[8.4.0.0²,?]tetradeca-2(7),3,5,9-tetraene-8,8-dione

InChI: InChI=1S/C14H15NO3S/c1-10(16)14-12-7-4-5-9-15(12)11-6-2-3-8-13(11)19(14,17)18/h2-3,6,8H,4-5,7,9H2,1H3

Composition: C (60.63%), H (5.45%), N (5.05%), O (17.31%), S (11.56%)

Molar Mass: 277.34

Atom Count: 34

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	277.077264521
Formal Charge	0
FSP3	0.36
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	CEKTVJJRUVFICK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.72
Topological Polar Surface Area	54.45
Polarizability	28.72
Ring Count	3
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H15NO3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00