4-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}-N-(2-methoxyphenyl)benzamide

4-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}-N-(2-methoxyphenyl)benzamide

Formula: C25H22N2O4

SMILES: COC1=CC=CC=C1NC(=O)C1=CC=C(C=C1)N1C(=O)C2C(C3C=CC2C2CC32)C1=O

IUPAC: 4-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}-N-(2-methoxyphenyl)benzamide

InChI: InChI=1/C25H22N2O4/c1-31-20-5-3-2-4-19(20)26-23(28)13-6-8-14(9-7-13)27-24(29)21-15-10-11-16(18-12-17(15)18)22(21)25(27)30/h2-11,15-18,21-22H,12H2,1H3,(H,26,28)

Composition: C (72.45%), H (5.35%), N (6.76%), O (15.44%)

Molar Mass: 414.461

Atom Count: 53

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	6
Exact Mass	414.157957196
Formal Charge	0
FSP3	0.32
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	MWIXYJCPLHLNDZ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	116.61
Topological Polar Surface Area	75.71
Polarizability	43.83
Ring Count	6
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H22N2O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00