N-{3-[(3-methoxyphenyl)carbamoyl]phenyl}-5-oxo-4-oxatricyclo[4.2.1.0³,?]nonane-9-carboxamide

N-{3-[(3-methoxyphenyl)carbamoyl]phenyl}-5-oxo-4-oxatricyclo[4.2.1.0³,?]nonane-9-carboxamide

Formula: C23H22N2O5

SMILES: COC1=CC=CC(NC(=O)C2=CC=CC(NC(=O)C3C4CC5OC(=O)C3C5C4)=C2)=C1

IUPAC: N-{3-[(3-methoxyphenyl)carbamoyl]phenyl}-5-oxo-4-oxatricyclo[4.2.1.0³,?]nonane-9-carboxamide

InChI: InChI=1/C23H22N2O5/c1-29-16-7-3-6-15(11-16)24-21(26)12-4-2-5-14(8-12)25-22(27)19-13-9-17-18(10-13)30-23(28)20(17)19/h2-8,11,13,17-20H,9-10H2,1H3,(H,24,26)(H,25,27)

Composition: C (67.97%), H (5.46%), N (6.89%), O (19.68%)

Molar Mass: 406.438

Atom Count: 52

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	5
Exact Mass	406.152871816
Formal Charge	0
FSP3	0.35
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	KUJQXIDRWVCJCT-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.15
Topological Polar Surface Area	93.73
Polarizability	41.83
Ring Count	5
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H22N2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00