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

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

Formula: C22H21NO5

SMILES: O=C(CCN1C(=O)C2C(C3C=CC2C2CC32)C1=O)OCC(=O)C1=CC=CC=C1

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

InChI: InChI=1/C22H21NO5/c24-17(12-4-2-1-3-5-12)11-28-18(25)8-9-23-21(26)19-13-6-7-14(16-10-15(13)16)20(19)22(23)27/h1-7,13-16,19-20H,8-11H2

Composition: C (69.65%), H (5.58%), N (3.69%), O (21.08%)

Molar Mass: 379.412

Atom Count: 49

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	6
Exact Mass	379.14197278
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	RAFNPBWVCMXROC-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.29
Topological Polar Surface Area	80.75
Polarizability	38.77
Ring Count	5
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H21NO5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00