N-(2,5-dimethylphenyl)-2-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}propanamide

N-(2,5-dimethylphenyl)-2-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}propanamide

Formula: C20H22N2O3

SMILES: CC(N1C(=O)C2C3CC(C=C3)C2C1=O)C(=O)NC1=CC(C)=CC=C1C

IUPAC: N-(2,5-dimethylphenyl)-2-{3,5-dioxo-4-azatricyclo[5.2.1.0²,?]dec-8-en-4-yl}propanamide

InChI: InChI=1/C20H22N2O3/c1-10-4-5-11(2)15(8-10)21-18(23)12(3)22-19(24)16-13-6-7-14(9-13)17(16)20(22)25/h4-8,12-14,16-17H,9H2,1-3H3,(H,21,23)

Composition: C (70.99%), H (6.55%), N (8.28%), O (14.18%)

Molar Mass: 338.407

Atom Count: 47

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	5
Exact Mass	338.163042576
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	HHHAUZRPAVWUMN-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.48
Topological Polar Surface Area	66.48
Polarizability	36.01
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H22N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00