1-oxo-1-phenylpropan-2-yl 4-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}benzoate

1-oxo-1-phenylpropan-2-yl 4-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}benzoate

Formula: C27H23NO5

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

IUPAC: 1-oxo-1-phenylpropan-2-yl 4-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}benzoate

InChI: InChI=1/C27H23NO5/c1-14(24(29)15-5-3-2-4-6-15)33-27(32)16-7-9-17(10-8-16)28-25(30)22-18-11-12-19(21-13-20(18)21)23(22)26(28)31/h2-12,14,18-23H,13H2,1H3

Composition: C (73.46%), H (5.25%), N (3.17%), O (18.12%)

Molar Mass: 441.483

Atom Count: 56

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	7
Exact Mass	441.157622845
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	HLKNOIIRDSUWSK-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	121.03
Topological Polar Surface Area	80.75
Polarizability	46.45
Ring Count	6
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C27H23NO5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00