4-{[(2,5-dimethylphenyl)amino]methyl}-4-azatricyclo[5.2.1.0²,?]dec-8-ene-3,5-dione

4-{[(2,5-dimethylphenyl)amino]methyl}-4-azatricyclo[5.2.1.0²,?]dec-8-ene-3,5-dione

Formula: C18H20N2O2

SMILES: CC1=CC=C(C)C(NCN2C(=O)C3C4CC(C=C4)C3C2=O)=C1

IUPAC: 4-{[(2,5-dimethylphenyl)amino]methyl}-4-azatricyclo[5.2.1.0²,?]dec-8-ene-3,5-dione

InChI: InChI=1/C18H20N2O2/c1-10-3-4-11(2)14(7-10)19-9-20-17(21)15-12-5-6-13(8-12)16(15)18(20)22/h3-7,12-13,15-16,19H,8-9H2,1-2H3

Composition: C (72.95%), H (6.80%), N (9.45%), O (10.80%)

Molar Mass: 296.37

Atom Count: 42

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	4
Exact Mass	296.152477892
Formal Charge	0
FSP3	0.44
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YLJDBQDWOQWHCJ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.71
Topological Polar Surface Area	49.41
Polarizability	32.27
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H20N2O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00