2-{16,18-dioxo-17-azapentacyclo[6.6.5.0²,?.0?,¹?.0¹?,¹?]nonadeca-2(7),3,5,9(14),10,12-hexaen-17-yl}-3-methylbutanoic acid

2-{16,18-dioxo-17-azapentacyclo[6.6.5.0²,?.0?,¹?.0¹?,¹?]nonadeca-2(7),3,5,9(14),10,12-hexaen-17-yl}-3-methylbutanoic acid

Formula: C23H21NO4

SMILES: CC(C)C(N1C(=O)C2C(C3C4=C(C=CC=C4)C2C2=C3C=CC=C2)C1=O)C(O)=O

IUPAC: 2-{16,18-dioxo-17-azapentacyclo[6.6.5.0²,?.0?,¹?.0¹?,¹?]nonadeca-2(7),3,5,9(14),10,12-hexaen-17-yl}-3-methylbutanoic acid

InChI: InChI=1/C23H21NO4/c1-11(2)20(23(27)28)24-21(25)18-16-12-7-3-4-8-13(12)17(19(18)22(24)26)15-10-6-5-9-14(15)16/h3-11,16-20H,1-2H3,(H,27,28)

Composition: C (73.58%), H (5.64%), N (3.73%), O (17.05%)

Molar Mass: 375.424

Atom Count: 49

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	3
Exact Mass	375.14705816
Formal Charge	0
FSP3	0.35
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	AKFSMLYJKZHSPM-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	102.46
Topological Polar Surface Area	74.68
Polarizability	39.78
Ring Count	5
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H21NO4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00