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

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

Formula: C21H22N2O3

SMILES: CC(N1C(=O)C2C(C3C=CC2C2CC32)C1=O)C(=O)NC1=CC=CC=C1C

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

InChI: InChI=1/C21H22N2O3/c1-10-5-3-4-6-16(10)22-19(24)11(2)23-20(25)17-12-7-8-13(15-9-14(12)15)18(17)21(23)26/h3-8,11-15,17-18H,9H2,1-2H3,(H,22,24)

Composition: C (71.98%), H (6.33%), N (7.99%), O (13.70%)

Molar Mass: 350.418

Atom Count: 48

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	7
Exact Mass	350.163042576
Formal Charge	0
FSP3	0.48
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	QIMKMAGFMXHKFJ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.73
Topological Polar Surface Area	66.48
Polarizability	37.21
Ring Count	5
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H22N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00