5-(furan-2-yl)-11-methyl-8-thia-4,6-diazatricyclo[7.4.0.0²,?]trideca-1(9),2(7)-dien-3-one

5-(furan-2-yl)-11-methyl-8-thia-4,6-diazatricyclo[7.4.0.0²,?]trideca-1(9),2(7)-dien-3-one

Formula: C15H16N2O2S

SMILES: CC1CCC2=C(C1)SC1=C2C(=O)NC(N1)C1=CC=CO1

IUPAC: 5-(furan-2-yl)-11-methyl-8-thia-4,6-diazatricyclo[7.4.0.0²,?]trideca-1(9),2(7)-dien-3-one

InChI: InChI=1/C15H16N2O2S/c1-8-4-5-9-11(7-8)20-15-12(9)14(18)16-13(17-15)10-3-2-6-19-10/h2-3,6,8,13,17H,4-5,7H2,1H3,(H,16,18)

Composition: C (62.48%), H (5.59%), N (9.71%), O (11.10%), S (11.12%)

Molar Mass: 288.37

Atom Count: 36

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	288.093248937
Formal Charge	0
FSP3	0.4
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	PGLDYDOEPXXFBV-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.23
Topological Polar Surface Area	54.27
Polarizability	28.89
Ring Count	4
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H16N2O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00