3-(3,4-dimethoxyphenyl)-3-azatricyclo[7.3.1.0?,¹³]trideca-1(13),5,7,9,11-pentaene-2,4-dione

3-(3,4-dimethoxyphenyl)-3-azatricyclo[7.3.1.0?,¹³]trideca-1(13),5,7,9,11-pentaene-2,4-dione

Formula: C20H15NO4

SMILES: COC1=CC=C(C=C1OC)N1C(=O)C2=CC=CC3=CC=CC(C1=O)=C23

IUPAC: 3-(3,4-dimethoxyphenyl)-3-azatricyclo[7.3.1.0?,¹³]trideca-1(13),5,7,9,11-pentaene-2,4-dione

InChI: InChI=1S/C20H15NO4/c1-24-16-10-9-13(11-17(16)25-2)21-19(22)14-7-3-5-12-6-4-8-15(18(12)14)20(21)23/h3-11H,1-2H3

Composition: C (72.06%), H (4.54%), N (4.20%), O (19.20%)

Molar Mass: 333.343

Atom Count: 40

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	333.100107967
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	APOLMJNSRZYLLR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.37
Topological Polar Surface Area	55.84
Polarizability	36.64
Ring Count	4
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H15NO4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00